3-(3-methylphenyl)-N-propan-2-yl-5-thiomorpholin-4-ylcarbonyl-piperidine-1-carboxamide

Systemtic Name: 3-(3-methylphenyl)-N-propan-2-yl-5-thiomorpholin-4-ylcarbonyl-piperidine-1-carboxamide Openeye Name: N-isopropyl-3-(m-tolyl)-5-(thiomorpholine-4-carbonyl)piperidine-1-carboxamide CAS Name: 3-(3-methylphenyl)-5-[oxo(thiomorpholin-4-yl)methyl]-N-propan-2-yl-1-piperidinecarboxamide IUPAC Name: 3-(3-methylphenyl)-N-propan-2-yl-5-(thiomorpholine-4-carbonyl)piperidine-1-carboxamide Traditional Name: N-isopropyl-3-(m-tolyl)-5-(thiomorpholine-4-carbonyl)piperidine-1-carboxamide Formula: C21H31N3O2S MolecularWeight: 389.55474

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2CC(CN(C2)C(=O)NC(C)C)C(=O)N3CCSCC3

Isomeric SMILES

CC1=CC=CC(=C1)C2CC(CN(C2)C(=O)NC(C)C)C(=O)N3CCSCC3

InChI

InChI=1S/C21H31N3O2S/c1-15(2)22-21(26)24-13-18(17-6-4-5-16(3)11-17)12-19(14-24)20(25)23-7-9-27-10-8-23/h4-6,11,15,18-19H,7-10,12-14H2,1-3H3,(H,22,26)