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

Systemtic Name: 4-(4-chlorophenyl)sulfanyl-N-[4-(1-methylimidazol-2-yl)carbonylphenyl]butanamide Openeye Name: 4-(4-chlorophenyl)sulfanyl-N-[4-(1-methylimidazole-2-carbonyl)phenyl]butanamide CAS Name: 4-[(4-chlorophenyl)thio]-N-[4-[(1-methyl-2-imidazolyl)-oxomethyl]phenyl]butanamide IUPAC Name: 4-(4-chlorophenyl)sulfanyl-N-[4-(1-methylimidazole-2-carbonyl)phenyl]butanamide Traditional Name: 4-[(4-chlorophenyl)thio]-N-[4-(1-methylimidazole-2-carbonyl)phenyl]butyramide Formula: C21H20ClN3O2S MolecularWeight: 413.9204

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H20ClN3O2S/c1-25-13-12-23-21(25)20(27)15-4-8-17(9-5-15)24-19(26)3-2-14-28-18-10-6-16(22)7-11-18/h4-13H,2-3,14H2,1H3,(H,24,26)