3-(2-methylcyclohexyl)-N-(2-nitrophenyl)-4-(3-nitrophenyl)-1,3-thiazol-2-imine

Systemtic Name: 3-(2-methylcyclohexyl)-N-(2-nitrophenyl)-4-(3-nitrophenyl)-1,3-thiazol-2-imine Openeye Name: 3-(2-methylcyclohexyl)-N-(2-nitrophenyl)-4-(3-nitrophenyl)thiazol-2-imine CAS Name: 3-(2-methylcyclohexyl)-N-(2-nitrophenyl)-4-(3-nitrophenyl)-2-thiazolimine IUPAC Name: 3-(2-methylcyclohexyl)-N-(2-nitrophenyl)-4-(3-nitrophenyl)-1,3-thiazol-2-imine Traditional Name: [3-(2-methylcyclohexyl)-4-(3-nitrophenyl)-4-thiazolin-2-ylidene]-(2-nitrophenyl)amine Formula: C22H22N4O4S MolecularWeight: 438.49948

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1N2C(=CSC2=NC3=CC=CC=C3[N+](=O)[O-])C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CC1CCCCC1N2C(=CSC2=NC3=CC=CC=C3[N+](=O)[O-])C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H22N4O4S/c1-15-7-2-4-11-19(15)24-21(16-8-6-9-17(13-16)25(27)28)14-31-22(24)23-18-10-3-5-12-20(18)26(29)30/h3,5-6,8-10,12-15,19H,2,4,7,11H2,1H3