5-[1-(3-methoxyphenyl)carbonylpiperidin-3-yl]-3-[(4-methylphenyl)methyl]-2H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one

Systemtic Name: 5-[1-(3-methoxyphenyl)carbonylpiperidin-3-yl]-3-[(4-methylphenyl)methyl]-2H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one Openeye Name: 5-[1-(3-methoxybenzoyl)-3-piperidyl]-3-(p-tolylmethyl)-2H-triazolo[4,5-d]pyrimidin-7-one CAS Name: 5-[1-[(3-methoxyphenyl)-oxomethyl]-3-piperidinyl]-3-[(4-methylphenyl)methyl]-2H-triazolo[4,5-d]pyrimidin-7-one IUPAC Name: 5-[1-(3-methoxybenzoyl)piperidin-3-yl]-3-[(4-methylphenyl)methyl]-2H-triazolo[4,5-d]pyrimidin-7-one Traditional Name: 5-(1-m-anisoyl-3-piperidyl)-3-(4-methylbenzyl)-2H-triazolo[4,5-d]pyrimidin-7-one Formula: C25H26N6O3 MolecularWeight: 458.51234

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2C3=NC(=NC(=O)C3=NN2)C4CCCN(C4)C(=O)C5=CC(=CC=C5)OC

Isomeric SMILES

CC1=CC=C(C=C1)CN2C3=NC(=NC(=O)C3=NN2)C4CCCN(C4)C(=O)C5=CC(=CC=C5)OC

InChI

InChI=1S/C25H26N6O3/c1-16-8-10-17(11-9-16)14-31-23-21(28-29-31)24(32)27-22(26-23)19-6-4-12-30(15-19)25(33)18-5-3-7-20(13-18)34-2/h3,5,7-11,13,19,29H,4,6,12,14-15H2,1-2H3