3-(6-methylheptan-2-yl)-N-(2-nitrophenyl)-4-(3-nitrophenyl)-1,3-thiazol-2-imine

Systemtic Name: 3-(6-methylheptan-2-yl)-N-(2-nitrophenyl)-4-(3-nitrophenyl)-1,3-thiazol-2-imine Openeye Name: 3-(1,5-dimethylhexyl)-N-(2-nitrophenyl)-4-(3-nitrophenyl)thiazol-2-imine CAS Name: 3-(6-methylheptan-2-yl)-N-(2-nitrophenyl)-4-(3-nitrophenyl)-2-thiazolimine IUPAC Name: 3-(6-methylheptan-2-yl)-N-(2-nitrophenyl)-4-(3-nitrophenyl)-1,3-thiazol-2-imine Traditional Name: [3-(1,5-dimethylhexyl)-4-(3-nitrophenyl)-4-thiazolin-2-ylidene]-(2-nitrophenyl)amine Formula: C23H26N4O4S MolecularWeight: 454.54194

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCC(C)N1C(=CSC1=NC2=CC=CC=C2[N+](=O)[O-])C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)CCCC(C)N1C(=CSC1=NC2=CC=CC=C2[N+](=O)[O-])C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C23H26N4O4S/c1-16(2)8-6-9-17(3)25-22(18-10-7-11-19(14-18)26(28)29)15-32-23(25)24-20-12-4-5-13-21(20)27(30)31/h4-5,7,10-17H,6,8-9H2,1-3H3