[4-[(2E)-3-cyclohexyl-2-(4-methylphenyl)sulfonylimino-1,3-thiazol-4-yl]phenyl] benzoate

Systemtic Name: [4-[(2E)-3-cyclohexyl-2-(4-methylphenyl)sulfonylimino-1,3-thiazol-4-yl]phenyl] benzoate Openeye Name: [4-[(2E)-3-cyclohexyl-2-(p-tolylsulfonylimino)thiazol-4-yl]phenyl] benzoate CAS Name: benzoic acid [4-[(2E)-3-cyclohexyl-2-(4-methylphenyl)sulfonylimino-4-thiazolyl]phenyl] ester IUPAC Name: [4-[(2E)-3-cyclohexyl-2-(4-methylphenyl)sulfonylimino-1,3-thiazol-4-yl]phenyl] benzoate Traditional Name: benzoic acid [4-[(2E)-3-cyclohexyl-2-tosylimino-4-thiazolin-4-yl]phenyl] ester Formula: C29H28N2O4S2 MolecularWeight: 532.67362

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N=C2N(C(=CS2)C3=CC=C(C=C3)OC(=O)C4=CC=CC=C4)C5CCCCC5

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)/N=C/2\N(C(=CS2)C3=CC=C(C=C3)OC(=O)C4=CC=CC=C4)C5CCCCC5

InChI

InChI=1S/C29H28N2O4S2/c1-21-12-18-26(19-13-21)37(33,34)30-29-31(24-10-6-3-7-11-24)27(20-36-29)22-14-16-25(17-15-22)35-28(32)23-8-4-2-5-9-23/h2,4-5,8-9,12-20,24H,3,6-7,10-11H2,1H3/b30-29+