N-[(3S)-1-(3-chloranyl-2-methyl-phenyl)sulfonylpiperidin-3-yl]-3-phenoxy-benzamide

Systemtic Name: N-[(3S)-1-(3-chloranyl-2-methyl-phenyl)sulfonylpiperidin-3-yl]-3-phenoxy-benzamide Openeye Name: N-[(3S)-1-(3-chloro-2-methyl-phenyl)sulfonyl-3-piperidyl]-3-phenoxy-benzamide CAS Name: N-[(3S)-1-(3-chloro-2-methylphenyl)sulfonyl-3-piperidinyl]-3-phenoxybenzamide IUPAC Name: N-[(3S)-1-(3-chloro-2-methylphenyl)sulfonylpiperidin-3-yl]-3-phenoxybenzamide Traditional Name: N-[(3S)-1-(3-chloro-2-methyl-phenyl)sulfonyl-3-piperidyl]-3-phenoxy-benzamide Formula: C25H25ClN2O4S MolecularWeight: 484.995

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)S(=O)(=O)N2CCCC(C2)NC(=O)C3=CC(=CC=C3)OC4=CC=CC=C4

Isomeric SMILES

CC1=C(C=CC=C1Cl)S(=O)(=O)N2CCC[C@@H](C2)NC(=O)C3=CC(=CC=C3)OC4=CC=CC=C4

InChI

InChI=1S/C25H25ClN2O4S/c1-18-23(26)13-6-14-24(18)33(30,31)28-15-7-9-20(17-28)27-25(29)19-8-5-12-22(16-19)32-21-10-3-2-4-11-21/h2-6,8,10-14,16,20H,7,9,15,17H2,1H3,(H,27,29)/t20-/m0/s1