(3R,4R)-1-(1,4-dithiepan-6-yl)-4-(4-pyridin-2-ylpiperazin-1-yl)piperidin-3-ol

Systemtic Name: (3R,4R)-1-(1,4-dithiepan-6-yl)-4-(4-pyridin-2-ylpiperazin-1-yl)piperidin-3-ol Openeye Name: (3R,4R)-1-(1,4-dithiepan-6-yl)-4-[4-(2-pyridyl)piperazin-1-yl]piperidin-3-ol CAS Name: (3R,4R)-1-(1,4-dithiepan-6-yl)-4-[4-(2-pyridinyl)-1-piperazinyl]-3-piperidinol IUPAC Name: (3R,4R)-1-(1,4-dithiepan-6-yl)-4-(4-pyridin-2-ylpiperazin-1-yl)piperidin-3-ol Traditional Name: (3R,4R)-1-(1,4-dithiepan-6-yl)-4-[4-(2-pyridyl)piperazino]piperidin-3-ol Formula: C19H30N4OS2 MolecularWeight: 394.5977

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(C1N2CCN(CC2)C3=CC=CC=N3)O)C4CSCCSC4

Isomeric SMILES

C1CN(C[C@H]([C@@H]1N2CCN(CC2)C3=CC=CC=N3)O)C4CSCCSC4

InChI

InChI=1S/C19H30N4OS2/c24-18-13-23(16-14-25-11-12-26-15-16)6-4-17(18)21-7-9-22(10-8-21)19-3-1-2-5-20-19/h1-3,5,16-18,24H,4,6-15H2/t17-,18-/m1/s1