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

Systemtic Name: 3-[(2,4-dichlorophenyl)methyl]-5-(1-propylsulfonylpiperidin-4-yl)-2H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one Openeye Name: 3-[(2,4-dichlorophenyl)methyl]-5-(1-propylsulfonyl-4-piperidyl)-2H-triazolo[4,5-d]pyrimidin-7-one CAS Name: 3-[(2,4-dichlorophenyl)methyl]-5-(1-propylsulfonyl-4-piperidinyl)-2H-triazolo[4,5-d]pyrimidin-7-one IUPAC Name: 3-[(2,4-dichlorophenyl)methyl]-5-(1-propylsulfonylpiperidin-4-yl)-2H-triazolo[4,5-d]pyrimidin-7-one Traditional Name: 3-(2,4-dichlorobenzyl)-5-(1-propylsulfonyl-4-piperidyl)-2H-triazolo[4,5-d]pyrimidin-7-one Formula: C19H22Cl2N6O3S MolecularWeight: 485.38738

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)N1CCC(CC1)C2=NC(=O)C3=NNN(C3=N2)CC4=C(C=C(C=C4)Cl)Cl

Isomeric SMILES

CCCS(=O)(=O)N1CCC(CC1)C2=NC(=O)C3=NNN(C3=N2)CC4=C(C=C(C=C4)Cl)Cl

InChI

InChI=1S/C19H22Cl2N6O3S/c1-2-9-31(29,30)26-7-5-12(6-8-26)17-22-18-16(19(28)23-17)24-25-27(18)11-13-3-4-14(20)10-15(13)21/h3-4,10,12,25H,2,5-9,11H2,1H3