5-methyl-2-(phenylmethylsulfanyl)-7-piperidin-1-yl-[1,2,4]triazolo[1,5-a]pyrimidine

Systemtic Name: 5-methyl-2-(phenylmethylsulfanyl)-7-piperidin-1-yl-[1,2,4]triazolo[1,5-a]pyrimidine Openeye Name: 2-benzylsulfanyl-5-methyl-7-(1-piperidyl)-[1,2,4]triazolo[1,5-a]pyrimidine CAS Name: 5-methyl-2-(phenylmethylthio)-7-(1-piperidinyl)-[1,2,4]triazolo[1,5-a]pyrimidine IUPAC Name: 2-benzylsulfanyl-5-methyl-7-piperidin-1-yl-[1,2,4]triazolo[1,5-a]pyrimidine Traditional Name: 2-(benzylthio)-5-methyl-7-piperidino-[1,2,4]triazolo[1,5-a]pyrimidine Formula: C18H21N5S MolecularWeight: 339.45784

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=NC(=NN2C(=C1)N3CCCCC3)SCC4=CC=CC=C4

Isomeric SMILES

CC1=NC2=NC(=NN2C(=C1)N3CCCCC3)SCC4=CC=CC=C4

InChI

InChI=1S/C18H21N5S/c1-14-12-16(22-10-6-3-7-11-22)23-17(19-14)20-18(21-23)24-13-15-8-4-2-5-9-15/h2,4-5,8-9,12H,3,6-7,10-11,13H2,1H3