(3R,4R)-4-(4-methylpiperazin-1-yl)-1-[(3-methylsulfanylphenyl)methyl]piperidin-3-ol

Systemtic Name: (3R,4R)-4-(4-methylpiperazin-1-yl)-1-[(3-methylsulfanylphenyl)methyl]piperidin-3-ol Openeye Name: (3R,4R)-4-(4-methylpiperazin-1-yl)-1-[(3-methylsulfanylphenyl)methyl]piperidin-3-ol CAS Name: (3R,4R)-4-(4-methyl-1-piperazinyl)-1-[[3-(methylthio)phenyl]methyl]-3-piperidinol IUPAC Name: (3R,4R)-4-(4-methylpiperazin-1-yl)-1-[(3-methylsulfanylphenyl)methyl]piperidin-3-ol Traditional Name: (3R,4R)-4-(4-methylpiperazino)-1-[3-(methylthio)benzyl]piperidin-3-ol Formula: C18H29N3OS MolecularWeight: 335.50736

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2CCN(CC2O)CC3=CC(=CC=C3)SC

Isomeric SMILES

CN1CCN(CC1)[C@@H]2CCN(C[C@H]2O)CC3=CC(=CC=C3)SC

InChI

InChI=1S/C18H29N3OS/c1-19-8-10-21(11-9-19)17-6-7-20(14-18(17)22)13-15-4-3-5-16(12-15)23-2/h3-5,12,17-18,22H,6-11,13-14H2,1-2H3/t17-,18-/m1/s1