methyl 4-[(2-methylsulfanyl-3-phenyl-imidazol-4-yl)carbonylamino]butanoate

Systemtic Name: methyl 4-[(2-methylsulfanyl-3-phenyl-imidazol-4-yl)carbonylamino]butanoate Openeye Name: methyl 4-[(2-methylsulfanyl-3-phenyl-imidazole-4-carbonyl)amino]butanoate CAS Name: 4-[[[2-(methylthio)-3-phenyl-4-imidazolyl]-oxomethyl]amino]butanoic acid methyl ester IUPAC Name: methyl 4-[(2-methylsulfanyl-3-phenylimidazole-4-carbonyl)amino]butanoate Traditional Name: 4-[[2-(methylthio)-3-phenyl-imidazole-4-carbonyl]amino]butyric acid methyl ester Formula: C16H19N3O3S MolecularWeight: 333.40536

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCNC(=O)C1=CN=C(N1C2=CC=CC=C2)SC

Isomeric SMILES

COC(=O)CCCNC(=O)C1=CN=C(N1C2=CC=CC=C2)SC

InChI

InChI=1S/C16H19N3O3S/c1-22-14(20)9-6-10-17-15(21)13-11-18-16(23-2)19(13)12-7-4-3-5-8-12/h3-5,7-8,11H,6,9-10H2,1-2H3,(H,17,21)