2-[2-[5-chloranyl-1-(phenylmethyl)benzimidazol-2-yl]sulfanylethanoylamino]thiophene-3-carboxamide

Systemtic Name: 2-[2-[5-chloranyl-1-(phenylmethyl)benzimidazol-2-yl]sulfanylethanoylamino]thiophene-3-carboxamide Openeye Name: 2-[[2-(1-benzyl-5-chloro-benzimidazol-2-yl)sulfanylacetyl]amino]thiophene-3-carboxamide CAS Name: 2-[[2-[[5-chloro-1-(phenylmethyl)-2-benzimidazolyl]thio]-1-oxoethyl]amino]-3-thiophenecarboxamide IUPAC Name: 2-[[2-(1-benzyl-5-chlorobenzimidazol-2-yl)sulfanylacetyl]amino]thiophene-3-carboxamide Traditional Name: 2-[[2-[(1-benzyl-5-chloro-benzimidazol-2-yl)thio]acetyl]amino]thiophene-3-carboxamide Formula: C21H17ClN4O2S2 MolecularWeight: 456.96828

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C3=C(C=C(C=C3)Cl)N=C2SCC(=O)NC4=C(C=CS4)C(=O)N

Isomeric SMILES

C1=CC=C(C=C1)CN2C3=C(C=C(C=C3)Cl)N=C2SCC(=O)NC4=C(C=CS4)C(=O)N

InChI

InChI=1S/C21H17ClN4O2S2/c22-14-6-7-17-16(10-14)24-21(26(17)11-13-4-2-1-3-5-13)30-12-18(27)25-20-15(19(23)28)8-9-29-20/h1-10H,11-12H2,(H2,23,28)(H,25,27)