4-[[4-methyl-5-[1-(2-phenylpropyl)piperidin-4-yl]-1,2,4-triazol-3-yl]sulfanylmethyl]pyridine

Systemtic Name: 4-[[4-methyl-5-[1-(2-phenylpropyl)piperidin-4-yl]-1,2,4-triazol-3-yl]sulfanylmethyl]pyridine Openeye Name: 4-[[4-methyl-5-[1-(2-phenylpropyl)-4-piperidyl]-1,2,4-triazol-3-yl]sulfanylmethyl]pyridine CAS Name: 4-[[[4-methyl-5-[1-(2-phenylpropyl)-4-piperidinyl]-1,2,4-triazol-3-yl]thio]methyl]pyridine IUPAC Name: 4-[[4-methyl-5-[1-(2-phenylpropyl)piperidin-4-yl]-1,2,4-triazol-3-yl]sulfanylmethyl]pyridine Traditional Name: 4-[[[4-methyl-5-[1-(2-phenylpropyl)-4-piperidyl]-1,2,4-triazol-3-yl]thio]methyl]pyridine Formula: C23H29N5S MolecularWeight: 407.57486

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1CCC(CC1)C2=NN=C(N2C)SCC3=CC=NC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(CN1CCC(CC1)C2=NN=C(N2C)SCC3=CC=NC=C3)C4=CC=CC=C4

InChI

InChI=1S/C23H29N5S/c1-18(20-6-4-3-5-7-20)16-28-14-10-21(11-15-28)22-25-26-23(27(22)2)29-17-19-8-12-24-13-9-19/h3-9,12-13,18,21H,10-11,14-17H2,1-2H3