(2R)-N-(4-methyl-2-nitro-phenyl)-2-phenyl-2-(1-propylimidazol-2-yl)sulfanyl-ethanamide

Systemtic Name: (2R)-N-(4-methyl-2-nitro-phenyl)-2-phenyl-2-(1-propylimidazol-2-yl)sulfanyl-ethanamide Openeye Name: (2R)-N-(4-methyl-2-nitro-phenyl)-2-phenyl-2-(1-propylimidazol-2-yl)sulfanyl-acetamide CAS Name: (2R)-N-(4-methyl-2-nitrophenyl)-2-phenyl-2-[(1-propyl-2-imidazolyl)thio]acetamide IUPAC Name: (2R)-N-(4-methyl-2-nitrophenyl)-2-phenyl-2-(1-propylimidazol-2-yl)sulfanylacetamide Traditional Name: (2R)-N-(4-methyl-2-nitro-phenyl)-2-phenyl-2-[(1-propylimidazol-2-yl)thio]acetamide Formula: C21H22N4O3S MolecularWeight: 410.48938

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=CN=C1SC(C2=CC=CC=C2)C(=O)NC3=C(C=C(C=C3)C)[N+](=O)[O-]

Isomeric SMILES

CCCN1C=CN=C1S[C@H](C2=CC=CC=C2)C(=O)NC3=C(C=C(C=C3)C)[N+](=O)[O-]

InChI

InChI=1S/C21H22N4O3S/c1-3-12-24-13-11-22-21(24)29-19(16-7-5-4-6-8-16)20(26)23-17-10-9-15(2)14-18(17)25(27)28/h4-11,13-14,19H,3,12H2,1-2H3,(H,23,26)/t19-/m1/s1