methyl 3-[2-[(4-methyl-1H-benzimidazol-2-yl)sulfanyl]ethanoylamino]thiophene-2-carboxylate

Systemtic Name: methyl 3-[2-[(4-methyl-1H-benzimidazol-2-yl)sulfanyl]ethanoylamino]thiophene-2-carboxylate Openeye Name: methyl 3-[[2-[(4-methyl-1H-benzimidazol-2-yl)sulfanyl]acetyl]amino]thiophene-2-carboxylate CAS Name: 3-[[2-[(4-methyl-1H-benzimidazol-2-yl)thio]-1-oxoethyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[[2-[(4-methyl-1H-benzimidazol-2-yl)sulfanyl]acetyl]amino]thiophene-2-carboxylate Traditional Name: 3-[[2-[(4-methyl-1H-benzimidazol-2-yl)thio]acetyl]amino]thiophene-2-carboxylic acid methyl ester Formula: C16H15N3O3S2 MolecularWeight: 361.4386

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)NC(=N2)SCC(=O)NC3=C(SC=C3)C(=O)OC

Isomeric SMILES

CC1=C2C(=CC=C1)NC(=N2)SCC(=O)NC3=C(SC=C3)C(=O)OC

InChI

InChI=1S/C16H15N3O3S2/c1-9-4-3-5-10-13(9)19-16(18-10)24-8-12(20)17-11-6-7-23-14(11)15(21)22-2/h3-7H,8H2,1-2H3,(H,17,20)(H,18,19)