2-(1-cyclopropylimidazol-2-yl)sulfanyl-N-(2-methyl-3-nitro-phenyl)propanamide

Systemtic Name: 2-(1-cyclopropylimidazol-2-yl)sulfanyl-N-(2-methyl-3-nitro-phenyl)propanamide Openeye Name: 2-(1-cyclopropylimidazol-2-yl)sulfanyl-N-(2-methyl-3-nitro-phenyl)propanamide CAS Name: 2-[(1-cyclopropyl-2-imidazolyl)thio]-N-(2-methyl-3-nitrophenyl)propanamide IUPAC Name: 2-(1-cyclopropylimidazol-2-yl)sulfanyl-N-(2-methyl-3-nitrophenyl)propanamide Traditional Name: 2-[(1-cyclopropylimidazol-2-yl)thio]-N-(2-methyl-3-nitro-phenyl)propionamide Formula: C16H18N4O3S MolecularWeight: 346.40412

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])NC(=O)C(C)SC2=NC=CN2C3CC3

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])NC(=O)C(C)SC2=NC=CN2C3CC3

InChI

InChI=1S/C16H18N4O3S/c1-10-13(4-3-5-14(10)20(22)23)18-15(21)11(2)24-16-17-8-9-19(16)12-6-7-12/h3-5,8-9,11-12H,6-7H2,1-2H3,(H,18,21)