3-[(3-methylcyclohexylidene)amino]-4-(4-nitrophenyl)-N-pyridin-3-yl-1,3-thiazol-2-imine

Systemtic Name: 3-[(3-methylcyclohexylidene)amino]-4-(4-nitrophenyl)-N-pyridin-3-yl-1,3-thiazol-2-imine Openeye Name: 3-[(3-methylcyclohexylidene)amino]-4-(4-nitrophenyl)-N-(3-pyridyl)thiazol-2-imine CAS Name: 3-[(3-methylcyclohexylidene)amino]-4-(4-nitrophenyl)-N-(3-pyridinyl)-2-thiazolimine IUPAC Name: 3-[(3-methylcyclohexylidene)amino]-4-(4-nitrophenyl)-N-pyridin-3-yl-1,3-thiazol-2-imine Traditional Name: (3-methylcyclohexylidene)-[4-(4-nitrophenyl)-2-(3-pyridylimino)-4-thiazolin-3-yl]amine Formula: C21H21N5O2S MolecularWeight: 407.48874

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(=NN2C(=CSC2=NC3=CN=CC=C3)C4=CC=C(C=C4)[N+](=O)[O-])C1

Isomeric SMILES

CC1CCCC(=NN2C(=CSC2=NC3=CN=CC=C3)C4=CC=C(C=C4)[N+](=O)[O-])C1

InChI

InChI=1S/C21H21N5O2S/c1-15-4-2-5-17(12-15)24-25-20(16-7-9-19(10-8-16)26(27)28)14-29-21(25)23-18-6-3-11-22-13-18/h3,6-11,13-15H,2,4-5,12H2,1H3