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

Systemtic Name: N-(3,4-dimethylphenyl)-3-(3-methylbutyl)-4-(4-nitrophenyl)-1,3-thiazol-2-imine Openeye Name: N-(3,4-dimethylphenyl)-3-isopentyl-4-(4-nitrophenyl)thiazol-2-imine CAS Name: N-(3,4-dimethylphenyl)-3-(3-methylbutyl)-4-(4-nitrophenyl)-2-thiazolimine IUPAC Name: N-(3,4-dimethylphenyl)-3-(3-methylbutyl)-4-(4-nitrophenyl)-1,3-thiazol-2-imine Traditional Name: (3,4-dimethylphenyl)-[3-isoamyl-4-(4-nitrophenyl)-4-thiazolin-2-ylidene]amine Formula: C22H25N3O2S MolecularWeight: 395.5178

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H25N3O2S/c1-15(2)11-12-24-21(18-6-9-20(10-7-18)25(26)27)14-28-22(24)23-19-8-5-16(3)17(4)13-19/h5-10,13-15H,11-12H2,1-4H3