N-(4-methoxyphenyl)-3-[[[(4S)-4-phenylcyclohexen-1-yl]amino]carbamoyl]benzenesulfonamide

Systemtic Name: N-(4-methoxyphenyl)-3-[[[(4S)-4-phenylcyclohexen-1-yl]amino]carbamoyl]benzenesulfonamide Openeye Name: N-(4-methoxyphenyl)-3-[[[(4S)-4-phenylcyclohexen-1-yl]amino]carbamoyl]benzenesulfonamide CAS Name: N-(4-methoxyphenyl)-3-[oxo-[[(4S)-4-phenyl-1-cyclohexenyl]hydrazo]methyl]benzenesulfonamide IUPAC Name: N-(4-methoxyphenyl)-3-[[[(4S)-4-phenylcyclohexen-1-yl]amino]carbamoyl]benzenesulfonamide Traditional Name: N-(4-methoxyphenyl)-3-[[[(4S)-4-phenylcyclohexen-1-yl]amino]carbamoyl]benzenesulfonamide Formula: C26H27N3O4S MolecularWeight: 477.57528

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NS(=O)(=O)C2=CC=CC(=C2)C(=O)NNC3=CCC(CC3)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)NS(=O)(=O)C2=CC=CC(=C2)C(=O)NNC3=CC[C@H](CC3)C4=CC=CC=C4

InChI

InChI=1S/C26H27N3O4S/c1-33-24-16-14-23(15-17-24)29-34(31,32)25-9-5-8-21(18-25)26(30)28-27-22-12-10-20(11-13-22)19-6-3-2-4-7-19/h2-9,12,14-18,20,27,29H,10-11,13H2,1H3,(H,28,30)/t20-/m1/s1