2-(1-butyl-4,5-dimethyl-imidazol-2-yl)sulfanyl-N-(3-nitrophenyl)propanamide

Systemtic Name: 2-(1-butyl-4,5-dimethyl-imidazol-2-yl)sulfanyl-N-(3-nitrophenyl)propanamide Openeye Name: 2-(1-butyl-4,5-dimethyl-imidazol-2-yl)sulfanyl-N-(3-nitrophenyl)propanamide CAS Name: 2-[(1-butyl-4,5-dimethyl-2-imidazolyl)thio]-N-(3-nitrophenyl)propanamide IUPAC Name: 2-(1-butyl-4,5-dimethylimidazol-2-yl)sulfanyl-N-(3-nitrophenyl)propanamide Traditional Name: 2-[(1-butyl-4,5-dimethyl-imidazol-2-yl)thio]-N-(3-nitrophenyl)propionamide Formula: C18H24N4O3S MolecularWeight: 376.47316

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(N=C1SC(C)C(=O)NC2=CC(=CC=C2)[N+](=O)[O-])C)C

Isomeric SMILES

CCCCN1C(=C(N=C1SC(C)C(=O)NC2=CC(=CC=C2)[N+](=O)[O-])C)C

InChI

InChI=1S/C18H24N4O3S/c1-5-6-10-21-13(3)12(2)19-18(21)26-14(4)17(23)20-15-8-7-9-16(11-15)22(24)25/h7-9,11,14H,5-6,10H2,1-4H3,(H,20,23)