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

Systemtic Name: [4-[(2E)-3-cyclohexyl-2-thiophen-2-ylsulfonylimino-1,3-thiazol-4-yl]phenyl] benzoate Openeye Name: [4-[(2E)-3-cyclohexyl-2-(2-thienylsulfonylimino)thiazol-4-yl]phenyl] benzoate CAS Name: benzoic acid [4-[(2E)-3-cyclohexyl-2-thiophen-2-ylsulfonylimino-4-thiazolyl]phenyl] ester IUPAC Name: [4-[(2E)-3-cyclohexyl-2-thiophen-2-ylsulfonylimino-1,3-thiazol-4-yl]phenyl] benzoate Traditional Name: benzoic acid [4-[(2E)-3-cyclohexyl-2-(2-thienylsulfonylimino)-4-thiazolin-4-yl]phenyl] ester Formula: C26H24N2O4S3 MolecularWeight: 524.67476

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C(=CSC2=NS(=O)(=O)C3=CC=CS3)C4=CC=C(C=C4)OC(=O)C5=CC=CC=C5

Isomeric SMILES

C1CCC(CC1)N\2C(=CS/C2=N/S(=O)(=O)C3=CC=CS3)C4=CC=C(C=C4)OC(=O)C5=CC=CC=C5

InChI

InChI=1S/C26H24N2O4S3/c29-25(20-8-3-1-4-9-20)32-22-15-13-19(14-16-22)23-18-34-26(28(23)21-10-5-2-6-11-21)27-35(30,31)24-12-7-17-33-24/h1,3-4,7-9,12-18,21H,2,5-6,10-11H2/b27-26+