1-[4-(1-methylpiperidin-4-yl)piperidin-1-yl]-2-(pyridin-2-ylamino)-3-sulfanyl-propan-1-one

Systemtic Name: 1-[4-(1-methylpiperidin-4-yl)piperidin-1-yl]-2-(pyridin-2-ylamino)-3-sulfanyl-propan-1-one Openeye Name: 1-[4-(1-methyl-4-piperidyl)-1-piperidyl]-2-(2-pyridylamino)-3-sulfanyl-propan-1-one CAS Name: 3-mercapto-1-[4-(1-methyl-4-piperidinyl)-1-piperidinyl]-2-(2-pyridinylamino)-1-propanone IUPAC Name: 1-[4-(1-methylpiperidin-4-yl)piperidin-1-yl]-2-(pyridin-2-ylamino)-3-sulfanylpropan-1-one Traditional Name: 3-mercapto-1-[4-(1-methyl-4-piperidyl)piperidino]-2-(2-pyridylamino)propan-1-one Formula: C19H30N4OS MolecularWeight: 362.5327

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)C2CCN(CC2)C(=O)C(CS)NC3=CC=CC=N3

Isomeric SMILES

CN1CCC(CC1)C2CCN(CC2)C(=O)C(CS)NC3=CC=CC=N3

InChI

InChI=1S/C19H30N4OS/c1-22-10-5-15(6-11-22)16-7-12-23(13-8-16)19(24)17(14-25)21-18-4-2-3-9-20-18/h2-4,9,15-17,25H,5-8,10-14H2,1H3,(H,20,21)