1-[1-(2,4-dimethylphenyl)-4-(4-nitrophenyl)imidazol-2-yl]sulfanyl-3-phenyl-propan-2-one

Systemtic Name: 1-[1-(2,4-dimethylphenyl)-4-(4-nitrophenyl)imidazol-2-yl]sulfanyl-3-phenyl-propan-2-one Openeye Name: 1-[1-(2,4-dimethylphenyl)-4-(4-nitrophenyl)imidazol-2-yl]sulfanyl-3-phenyl-propan-2-one CAS Name: 1-[[1-(2,4-dimethylphenyl)-4-(4-nitrophenyl)-2-imidazolyl]thio]-3-phenyl-2-propanone IUPAC Name: 1-[1-(2,4-dimethylphenyl)-4-(4-nitrophenyl)imidazol-2-yl]sulfanyl-3-phenylpropan-2-one Traditional Name: 1-[[1-(2,4-dimethylphenyl)-4-(4-nitrophenyl)imidazol-2-yl]thio]-3-phenyl-acetone Formula: C26H23N3O3S MolecularWeight: 457.54412

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2C=C(N=C2SCC(=O)CC3=CC=CC=C3)C4=CC=C(C=C4)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=C(C=C1)N2C=C(N=C2SCC(=O)CC3=CC=CC=C3)C4=CC=C(C=C4)[N+](=O)[O-])C

InChI

InChI=1S/C26H23N3O3S/c1-18-8-13-25(19(2)14-18)28-16-24(21-9-11-22(12-10-21)29(31)32)27-26(28)33-17-23(30)15-20-6-4-3-5-7-20/h3-14,16H,15,17H2,1-2H3