2-(1-azanyl-4-phenyl-imidazol-2-yl)sulfanyl-N-(2,3-dimethyl-6-nitro-phenyl)ethanamide

Systemtic Name: 2-(1-azanyl-4-phenyl-imidazol-2-yl)sulfanyl-N-(2,3-dimethyl-6-nitro-phenyl)ethanamide Openeye Name: 2-(1-amino-4-phenyl-imidazol-2-yl)sulfanyl-N-(2,3-dimethyl-6-nitro-phenyl)acetamide CAS Name: 2-[(1-amino-4-phenyl-2-imidazolyl)thio]-N-(2,3-dimethyl-6-nitrophenyl)acetamide IUPAC Name: 2-(1-amino-4-phenylimidazol-2-yl)sulfanyl-N-(2,3-dimethyl-6-nitrophenyl)acetamide Traditional Name: 2-[(1-amino-4-phenyl-imidazol-2-yl)thio]-N-(2,3-dimethyl-6-nitro-phenyl)acetamide Formula: C19H19N5O3S MolecularWeight: 397.45086

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)[N+](=O)[O-])NC(=O)CSC2=NC(=CN2N)C3=CC=CC=C3)C

Isomeric SMILES

CC1=C(C(=C(C=C1)[N+](=O)[O-])NC(=O)CSC2=NC(=CN2N)C3=CC=CC=C3)C

InChI

InChI=1S/C19H19N5O3S/c1-12-8-9-16(24(26)27)18(13(12)2)22-17(25)11-28-19-21-15(10-23(19)20)14-6-4-3-5-7-14/h3-10H,11,20H2,1-2H3,(H,22,25)