3-(5-methylhexan-2-yl)-4-(4-nitrophenyl)-N-pyridin-3-yl-1,3-thiazol-2-imine

Systemtic Name: 3-(5-methylhexan-2-yl)-4-(4-nitrophenyl)-N-pyridin-3-yl-1,3-thiazol-2-imine Openeye Name: 3-(1,4-dimethylpentyl)-4-(4-nitrophenyl)-N-(3-pyridyl)thiazol-2-imine CAS Name: 3-(5-methylhexan-2-yl)-4-(4-nitrophenyl)-N-(3-pyridinyl)-2-thiazolimine IUPAC Name: 3-(5-methylhexan-2-yl)-4-(4-nitrophenyl)-N-pyridin-3-yl-1,3-thiazol-2-imine Traditional Name: [3-(1,4-dimethylpentyl)-4-(4-nitrophenyl)-4-thiazolin-2-ylidene]-(3-pyridyl)amine Formula: C21H24N4O2S MolecularWeight: 396.50586

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24N4O2S/c1-15(2)6-7-16(3)24-20(17-8-10-19(11-9-17)25(26)27)14-28-21(24)23-18-5-4-12-22-13-18/h4-5,8-16H,6-7H2,1-3H3