2-[1-(3-chlorophenyl)imidazol-2-yl]sulfanyl-N-(2-methyl-4-nitro-phenyl)propanamide

Systemtic Name: 2-[1-(3-chlorophenyl)imidazol-2-yl]sulfanyl-N-(2-methyl-4-nitro-phenyl)propanamide Openeye Name: 2-[1-(3-chlorophenyl)imidazol-2-yl]sulfanyl-N-(2-methyl-4-nitro-phenyl)propanamide CAS Name: 2-[[1-(3-chlorophenyl)-2-imidazolyl]thio]-N-(2-methyl-4-nitrophenyl)propanamide IUPAC Name: 2-[1-(3-chlorophenyl)imidazol-2-yl]sulfanyl-N-(2-methyl-4-nitrophenyl)propanamide Traditional Name: 2-[[1-(3-chlorophenyl)imidazol-2-yl]thio]-N-(2-methyl-4-nitro-phenyl)propionamide Formula: C19H17ClN4O3S MolecularWeight: 416.88128

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)C(C)SC2=NC=CN2C3=CC(=CC=C3)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)C(C)SC2=NC=CN2C3=CC(=CC=C3)Cl

InChI

InChI=1S/C19H17ClN4O3S/c1-12-10-16(24(26)27)6-7-17(12)22-18(25)13(2)28-19-21-8-9-23(19)15-5-3-4-14(20)11-15/h3-11,13H,1-2H3,(H,22,25)