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

Systemtic Name: N-(2,3-dimethylphenyl)-3-(6-methylheptan-2-yl)-4-(4-nitrophenyl)-1,3-thiazol-2-imine Openeye Name: 3-(1,5-dimethylhexyl)-N-(2,3-dimethylphenyl)-4-(4-nitrophenyl)thiazol-2-imine CAS Name: N-(2,3-dimethylphenyl)-3-(6-methylheptan-2-yl)-4-(4-nitrophenyl)-2-thiazolimine IUPAC Name: N-(2,3-dimethylphenyl)-3-(6-methylheptan-2-yl)-4-(4-nitrophenyl)-1,3-thiazol-2-imine Traditional Name: [3-(1,5-dimethylhexyl)-4-(4-nitrophenyl)-4-thiazolin-2-ylidene]-(2,3-dimethylphenyl)amine Formula: C25H31N3O2S MolecularWeight: 437.59754

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N=C2N(C(=CS2)C3=CC=C(C=C3)[N+](=O)[O-])C(C)CCCC(C)C)C

Isomeric SMILES

CC1=C(C(=CC=C1)N=C2N(C(=CS2)C3=CC=C(C=C3)[N+](=O)[O-])C(C)CCCC(C)C)C

InChI

InChI=1S/C25H31N3O2S/c1-17(2)8-6-10-19(4)27-24(21-12-14-22(15-13-21)28(29)30)16-31-25(27)26-23-11-7-9-18(3)20(23)5/h7,9,11-17,19H,6,8,10H2,1-5H3