N-[4-[[[(4R)-4-tert-butylcyclohexen-1-yl]amino]carbamoyl]phenyl]thiophene-2-sulfonamide

Systemtic Name: N-[4-[[[(4R)-4-tert-butylcyclohexen-1-yl]amino]carbamoyl]phenyl]thiophene-2-sulfonamide Openeye Name: N-[4-[[[(4R)-4-tert-butylcyclohexen-1-yl]amino]carbamoyl]phenyl]thiophene-2-sulfonamide CAS Name: N-[4-[[[(4R)-4-tert-butyl-1-cyclohexenyl]hydrazo]-oxomethyl]phenyl]-2-thiophenesulfonamide IUPAC Name: N-[4-[[[(4R)-4-tert-butylcyclohexen-1-yl]amino]carbamoyl]phenyl]thiophene-2-sulfonamide Traditional Name: N-[4-[[[(4R)-4-tert-butylcyclohexen-1-yl]amino]carbamoyl]phenyl]thiophene-2-sulfonamide Formula: C21H27N3O3S2 MolecularWeight: 433.58738

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CCC(=CC1)NNC(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=CS3

Isomeric SMILES

CC(C)(C)[C@@H]1CCC(=CC1)NNC(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C21H27N3O3S2/c1-21(2,3)16-8-12-17(13-9-16)22-23-20(25)15-6-10-18(11-7-15)24-29(26,27)19-5-4-14-28-19/h4-7,10-12,14,16,22,24H,8-9,13H2,1-3H3,(H,23,25)/t16-/m0/s1