(Q82142255)

English

ethyl 2-[[2-(1H-benzimidazol-2-ylsulfanyl)acetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

chemical compound

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Statements

type of chemical entity

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chemical compound

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415.10243353199996 dalton

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based on heuristic

inferred from InChI

chemical formula

C₂₀H₂₁N₃O₃S₂

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canonical SMILES

CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)CSC3=NC4=CC=CC=C4N3

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Identifiers

InChI=1S/C20H21N3O3S2/c1-2-26-19(25)17-12-7-3-6-10-15(12)28-18(17)23-16(24)11-27-20-21-13-8-4-5-9-14(13)22-20/h4-5,8-9H,2-3,6-7,10-11H2,1H3,(H,21,22)(H,23,24)

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GMYCGQTZBBVGLD-UHFFFAOYSA-N

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CAS Registry Number

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matched by identifier from

GMYCGQTZBBVGLD-UHFFFAOYSA-N

UniChem compound ID

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DSSTox substance ID

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matched by identifier from

GMYCGQTZBBVGLD-UHFFFAOYSA-N

DSSTOX compound identifier

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