N-[4-(4-piperidin-1-ylpiperidin-1-yl)carbonylphenyl]-2,3-dihydro-1,4-oxathiine-6-carboxamide

Systemtic Name: N-[4-(4-piperidin-1-ylpiperidin-1-yl)carbonylphenyl]-2,3-dihydro-1,4-oxathiine-6-carboxamide Openeye Name: N-[4-[4-(1-piperidyl)piperidine-1-carbonyl]phenyl]-2,3-dihydro-1,4-oxathiine-6-carboxamide CAS Name: N-[4-[oxo-[4-(1-piperidinyl)-1-piperidinyl]methyl]phenyl]-2,3-dihydro-1,4-oxathiin-6-carboxamide IUPAC Name: N-[4-(4-piperidin-1-ylpiperidine-1-carbonyl)phenyl]-2,3-dihydro-1,4-oxathiine-6-carboxamide Traditional Name: N-[4-(4-piperidinopiperidine-1-carbonyl)phenyl]-2,3-dihydro-1,4-oxathiin-6-carboxamide Formula: C22H29N3O3S MolecularWeight: 415.54896

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2CCN(CC2)C(=O)C3=CC=C(C=C3)NC(=O)C4=CSCCO4

Isomeric SMILES

C1CCN(CC1)C2CCN(CC2)C(=O)C3=CC=C(C=C3)NC(=O)C4=CSCCO4

InChI

InChI=1S/C22H29N3O3S/c26-21(20-16-29-15-14-28-20)23-18-6-4-17(5-7-18)22(27)25-12-8-19(9-13-25)24-10-2-1-3-11-24/h4-7,16,19H,1-3,8-15H2,(H,23,26)