methyl 2-[2-[5-chloranyl-1-(phenylmethyl)benzimidazol-2-yl]sulfanylethanoylamino]ethanoate

Systemtic Name: methyl 2-[2-[5-chloranyl-1-(phenylmethyl)benzimidazol-2-yl]sulfanylethanoylamino]ethanoate Openeye Name: methyl 2-[[2-(1-benzyl-5-chloro-benzimidazol-2-yl)sulfanylacetyl]amino]acetate CAS Name: 2-[[2-[[5-chloro-1-(phenylmethyl)-2-benzimidazolyl]thio]-1-oxoethyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[[2-(1-benzyl-5-chlorobenzimidazol-2-yl)sulfanylacetyl]amino]acetate Traditional Name: 2-[[2-[(1-benzyl-5-chloro-benzimidazol-2-yl)thio]acetyl]amino]acetic acid methyl ester Formula: C19H18ClN3O3S MolecularWeight: 403.88252

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CNC(=O)CSC1=NC2=C(N1CC3=CC=CC=C3)C=CC(=C2)Cl

Isomeric SMILES

COC(=O)CNC(=O)CSC1=NC2=C(N1CC3=CC=CC=C3)C=CC(=C2)Cl

InChI

InChI=1S/C19H18ClN3O3S/c1-26-18(25)10-21-17(24)12-27-19-22-15-9-14(20)7-8-16(15)23(19)11-13-5-3-2-4-6-13/h2-9H,10-12H2,1H3,(H,21,24)