3-[2-[(6-ethoxy-1H-benzimidazol-2-yl)sulfanyl]ethanoylamino]-4-methyl-benzoate

Systemtic Name: 3-[2-[(6-ethoxy-1H-benzimidazol-2-yl)sulfanyl]ethanoylamino]-4-methyl-benzoate Openeye Name: 3-[[2-[(6-ethoxy-1H-benzimidazol-2-yl)sulfanyl]acetyl]amino]-4-methyl-benzoate CAS Name: 3-[[2-[(6-ethoxy-1H-benzimidazol-2-yl)thio]-1-oxoethyl]amino]-4-methylbenzoate IUPAC Name: 3-[[2-[(6-ethoxy-1H-benzimidazol-2-yl)sulfanyl]acetyl]amino]-4-methylbenzoate Traditional Name: 3-[[2-[(6-ethoxy-1H-benzimidazol-2-yl)thio]acetyl]amino]-4-methyl-benzoate Formula: C19H18N3O4S- MolecularWeight: 384.42892

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(N2)SCC(=O)NC3=C(C=CC(=C3)C(=O)[O-])C

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(N2)SCC(=O)NC3=C(C=CC(=C3)C(=O)[O-])C

InChI

InChI=1S/C19H19N3O4S/c1-3-26-13-6-7-14-16(9-13)22-19(21-14)27-10-17(23)20-15-8-12(18(24)25)5-4-11(15)2/h4-9H,3,10H2,1-2H3,(H,20,23)(H,21,22)(H,24,25)/p-1