N-[4-[4-(4-chloranyl-2-methyl-phenoxy)piperidin-1-yl]piperidin-1-yl]sulfonyl-3-cyano-benzamide

Systemtic Name: N-[4-[4-(4-chloranyl-2-methyl-phenoxy)piperidin-1-yl]piperidin-1-yl]sulfonyl-3-cyano-benzamide Openeye Name: N-[[4-[4-(4-chloro-2-methyl-phenoxy)-1-piperidyl]-1-piperidyl]sulfonyl]-3-cyano-benzamide CAS Name: N-[[4-[4-(4-chloro-2-methylphenoxy)-1-piperidinyl]-1-piperidinyl]sulfonyl]-3-cyanobenzamide IUPAC Name: N-[4-[4-(4-chloro-2-methylphenoxy)piperidin-1-yl]piperidin-1-yl]sulfonyl-3-cyanobenzamide Traditional Name: N-[4-[4-(4-chloro-2-methyl-phenoxy)piperidino]piperidino]sulfonyl-3-cyano-benzamide Formula: C25H29ClN4O4S MolecularWeight: 517.04016

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)OC2CCN(CC2)C3CCN(CC3)S(=O)(=O)NC(=O)C4=CC=CC(=C4)C#N

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)OC2CCN(CC2)C3CCN(CC3)S(=O)(=O)NC(=O)C4=CC=CC(=C4)C#N

InChI

InChI=1S/C25H29ClN4O4S/c1-18-15-21(26)5-6-24(18)34-23-9-11-29(12-10-23)22-7-13-30(14-8-22)35(32,33)28-25(31)20-4-2-3-19(16-20)17-27/h2-6,15-16,22-23H,7-14H2,1H3,(H,28,31)