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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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