N-[4-(1-methylimidazol-2-yl)carbonylphenyl]-4-phenylsulfanyl-butanamide

Systemtic Name: N-[4-(1-methylimidazol-2-yl)carbonylphenyl]-4-phenylsulfanyl-butanamide Openeye Name: N-[4-(1-methylimidazole-2-carbonyl)phenyl]-4-phenylsulfanyl-butanamide CAS Name: N-[4-[(1-methyl-2-imidazolyl)-oxomethyl]phenyl]-4-(phenylthio)butanamide IUPAC Name: N-[4-(1-methylimidazole-2-carbonyl)phenyl]-4-phenylsulfanylbutanamide Traditional Name: N-[4-(1-methylimidazole-2-carbonyl)phenyl]-4-(phenylthio)butyramide Formula: C21H21N3O2S MolecularWeight: 379.47534

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1C(=O)C2=CC=C(C=C2)NC(=O)CCCSC3=CC=CC=C3

Isomeric SMILES

CN1C=CN=C1C(=O)C2=CC=C(C=C2)NC(=O)CCCSC3=CC=CC=C3

InChI

InChI=1S/C21H21N3O2S/c1-24-14-13-22-21(24)20(26)16-9-11-17(12-10-16)23-19(25)8-5-15-27-18-6-3-2-4-7-18/h2-4,6-7,9-14H,5,8,15H2,1H3,(H,23,25)