3-[[4,5-bis(4-methylphenyl)-1H-imidazol-2-yl]sulfanyl]-N-(2-methyl-5-nitro-phenyl)propanamide

Systemtic Name: 3-[[4,5-bis(4-methylphenyl)-1H-imidazol-2-yl]sulfanyl]-N-(2-methyl-5-nitro-phenyl)propanamide Openeye Name: 3-[[4,5-bis(p-tolyl)-1H-imidazol-2-yl]sulfanyl]-N-(2-methyl-5-nitro-phenyl)propanamide CAS Name: 3-[[4,5-bis(4-methylphenyl)-1H-imidazol-2-yl]thio]-N-(2-methyl-5-nitrophenyl)propanamide IUPAC Name: 3-[[4,5-bis(4-methylphenyl)-1H-imidazol-2-yl]sulfanyl]-N-(2-methyl-5-nitrophenyl)propanamide Traditional Name: 3-[[4,5-bis(p-tolyl)-1H-imidazol-2-yl]thio]-N-(2-methyl-5-nitro-phenyl)propionamide Formula: C27H26N4O3S MolecularWeight: 486.58534

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(N=C(N2)SCCC(=O)NC3=C(C=CC(=C3)[N+](=O)[O-])C)C4=CC=C(C=C4)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(N=C(N2)SCCC(=O)NC3=C(C=CC(=C3)[N+](=O)[O-])C)C4=CC=C(C=C4)C

InChI

InChI=1S/C27H26N4O3S/c1-17-4-9-20(10-5-17)25-26(21-11-6-18(2)7-12-21)30-27(29-25)35-15-14-24(32)28-23-16-22(31(33)34)13-8-19(23)3/h4-13,16H,14-15H2,1-3H3,(H,28,32)(H,29,30)