4-chloranyl-N-[(1R,2S)-2-[(4-oxidanylidene-6-propyl-1H-pyrimidin-2-yl)sulfanyl]cyclohexyl]benzenesulfonamide

Systemtic Name: 4-chloranyl-N-[(1R,2S)-2-[(4-oxidanylidene-6-propyl-1H-pyrimidin-2-yl)sulfanyl]cyclohexyl]benzenesulfonamide Openeye Name: 4-chloro-N-[(1R,2S)-2-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)sulfanyl]cyclohexyl]benzenesulfonamide CAS Name: 4-chloro-N-[(1R,2S)-2-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)thio]cyclohexyl]benzenesulfonamide IUPAC Name: 4-chloro-N-[(1R,2S)-2-[(4-oxo-6-propyl-1H-pyrimidin-2-yl)sulfanyl]cyclohexyl]benzenesulfonamide Traditional Name: 4-chloro-N-[(1R,2S)-2-[(4-keto-6-propyl-1H-pyrimidin-2-yl)thio]cyclohexyl]benzenesulfonamide Formula: C19H24ClN3O3S2 MolecularWeight: 441.99516

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=O)N=C(N1)SC2CCCCC2NS(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CCCC1=CC(=O)N=C(N1)S[C@H]2CCCC[C@H]2NS(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H24ClN3O3S2/c1-2-5-14-12-18(24)22-19(21-14)27-17-7-4-3-6-16(17)23-28(25,26)15-10-8-13(20)9-11-15/h8-12,16-17,23H,2-7H2,1H3,(H,21,22,24)/t16-,17+/m1/s1