3-(phenylmethyl)-5-(1-propylsulfonylpiperidin-3-yl)-2H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one

Systemtic Name: 3-(phenylmethyl)-5-(1-propylsulfonylpiperidin-3-yl)-2H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one Openeye Name: 3-benzyl-5-(1-propylsulfonyl-3-piperidyl)-2H-triazolo[4,5-d]pyrimidin-7-one CAS Name: 3-(phenylmethyl)-5-(1-propylsulfonyl-3-piperidinyl)-2H-triazolo[4,5-d]pyrimidin-7-one IUPAC Name: 3-benzyl-5-(1-propylsulfonylpiperidin-3-yl)-2H-triazolo[4,5-d]pyrimidin-7-one Traditional Name: 3-benzyl-5-(1-propylsulfonyl-3-piperidyl)-2H-triazolo[4,5-d]pyrimidin-7-one Formula: C19H24N6O3S MolecularWeight: 416.49726

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)N1CCCC(C1)C2=NC(=O)C3=NNN(C3=N2)CC4=CC=CC=C4

Isomeric SMILES

CCCS(=O)(=O)N1CCCC(C1)C2=NC(=O)C3=NNN(C3=N2)CC4=CC=CC=C4

InChI

InChI=1S/C19H24N6O3S/c1-2-11-29(27,28)24-10-6-9-15(13-24)17-20-18-16(19(26)21-17)22-23-25(18)12-14-7-4-3-5-8-14/h3-5,7-8,15,23H,2,6,9-13H2,1H3