(3S)-N-[4-(morpholin-4-ylmethyl)phenyl]-1-(phenylsulfonyl)piperidine-3-carboxamide

Systemtic Name: (3S)-N-[4-(morpholin-4-ylmethyl)phenyl]-1-(phenylsulfonyl)piperidine-3-carboxamide Openeye Name: (3S)-1-(benzenesulfonyl)-N-[4-(morpholinomethyl)phenyl]piperidine-3-carboxamide CAS Name: (3S)-1-(benzenesulfonyl)-N-[4-(4-morpholinylmethyl)phenyl]-3-piperidinecarboxamide IUPAC Name: (3S)-1-(benzenesulfonyl)-N-[4-(morpholin-4-ylmethyl)phenyl]piperidine-3-carboxamide Traditional Name: (3S)-1-besyl-N-[4-(morpholinomethyl)phenyl]nipecotamide Formula: C23H29N3O4S MolecularWeight: 443.55906

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)C2=CC=CC=C2)C(=O)NC3=CC=C(C=C3)CN4CCOCC4

Isomeric SMILES

C1C[C@@H](CN(C1)S(=O)(=O)C2=CC=CC=C2)C(=O)NC3=CC=C(C=C3)CN4CCOCC4

InChI

InChI=1S/C23H29N3O4S/c27-23(24-21-10-8-19(9-11-21)17-25-13-15-30-16-14-25)20-5-4-12-26(18-20)31(28,29)22-6-2-1-3-7-22/h1-3,6-11,20H,4-5,12-18H2,(H,24,27)/t20-/m0/s1