6-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]-2-piperidin-1-yl-1H-pyrimidin-4-one

Systemtic Name: 6-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]-2-piperidin-1-yl-1H-pyrimidin-4-one Openeye Name: 6-[(1-phenyltetrazol-5-yl)sulfanylmethyl]-2-(1-piperidyl)-1H-pyrimidin-4-one CAS Name: 6-[[(1-phenyl-5-tetrazolyl)thio]methyl]-2-(1-piperidinyl)-1H-pyrimidin-4-one IUPAC Name: 6-[(1-phenyltetrazol-5-yl)sulfanylmethyl]-2-piperidin-1-yl-1H-pyrimidin-4-one Traditional Name: 6-[[(1-phenyltetrazol-5-yl)thio]methyl]-2-piperidino-1H-pyrimidin-4-one Formula: C17H19N7OS MolecularWeight: 369.44406

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=NC(=O)C=C(N2)CSC3=NN=NN3C4=CC=CC=C4

Isomeric SMILES

C1CCN(CC1)C2=NC(=O)C=C(N2)CSC3=NN=NN3C4=CC=CC=C4

InChI

InChI=1S/C17H19N7OS/c25-15-11-13(18-16(19-15)23-9-5-2-6-10-23)12-26-17-20-21-22-24(17)14-7-3-1-4-8-14/h1,3-4,7-8,11H,2,5-6,9-10,12H2,(H,18,19,25)