methyl 3-methyl-2-[2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]ethanoylamino]pentanoate

Systemtic Name: methyl 3-methyl-2-[2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]ethanoylamino]pentanoate Openeye Name: methyl 3-methyl-2-[[2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]acetyl]amino]pentanoate CAS Name: 3-methyl-2-[[2-[(6-methyl-1H-benzimidazol-2-yl)thio]-1-oxoethyl]amino]pentanoic acid methyl ester IUPAC Name: methyl 3-methyl-2-[[2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]acetyl]amino]pentanoate Traditional Name: 3-methyl-2-[[2-[(6-methyl-1H-benzimidazol-2-yl)thio]acetyl]amino]valeric acid methyl ester Formula: C17H23N3O3S MolecularWeight: 349.44782

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)OC)NC(=O)CSC1=NC2=C(N1)C=C(C=C2)C

Isomeric SMILES

CCC(C)C(C(=O)OC)NC(=O)CSC1=NC2=C(N1)C=C(C=C2)C

InChI

InChI=1S/C17H23N3O3S/c1-5-11(3)15(16(22)23-4)20-14(21)9-24-17-18-12-7-6-10(2)8-13(12)19-17/h6-8,11,15H,5,9H2,1-4H3,(H,18,19)(H,20,21)