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

Systemtic Name: 3-[(4-methylcyclohexylidene)amino]-N-(4-morpholin-4-ylsulfonylphenyl)-4-(4-nitrophenyl)-1,3-thiazol-2-imine Openeye Name: 3-[(4-methylcyclohexylidene)amino]-N-(4-morpholinosulfonylphenyl)-4-(4-nitrophenyl)thiazol-2-imine CAS Name: 3-[(4-methylcyclohexylidene)amino]-N-[4-(4-morpholinylsulfonyl)phenyl]-4-(4-nitrophenyl)-2-thiazolimine IUPAC Name: 3-[(4-methylcyclohexylidene)amino]-N-(4-morpholin-4-ylsulfonylphenyl)-4-(4-nitrophenyl)-1,3-thiazol-2-imine Traditional Name: (4-methylcyclohexylidene)-[2-(4-morpholinosulfonylphenyl)imino-4-(4-nitrophenyl)-4-thiazolin-3-yl]amine Formula: C26H29N5O5S2 MolecularWeight: 555.66896

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(=NN2C(=CSC2=NC3=CC=C(C=C3)S(=O)(=O)N4CCOCC4)C5=CC=C(C=C5)[N+](=O)[O-])CC1

Isomeric SMILES

CC1CCC(=NN2C(=CSC2=NC3=CC=C(C=C3)S(=O)(=O)N4CCOCC4)C5=CC=C(C=C5)[N+](=O)[O-])CC1

InChI

InChI=1S/C26H29N5O5S2/c1-19-2-6-22(7-3-19)28-30-25(20-4-10-23(11-5-20)31(32)33)18-37-26(30)27-21-8-12-24(13-9-21)38(34,35)29-14-16-36-17-15-29/h4-5,8-13,18-19H,2-3,6-7,14-17H2,1H3