3-butyl-5-[(2-chlorophenyl)methyl]-2,4-dihydropyrazolo[4,3-d]pyrimidin-7-one

Systemtic Name: 3-butyl-5-[(2-chlorophenyl)methyl]-2,4-dihydropyrazolo[4,3-d]pyrimidin-7-one Openeye Name: 3-butyl-5-[(2-chlorophenyl)methyl]-2,4-dihydropyrazolo[4,3-d]pyrimidin-7-one CAS Name: 3-butyl-5-[(2-chlorophenyl)methyl]-2,4-dihydropyrazolo[4,3-d]pyrimidin-7-one IUPAC Name: 3-butyl-5-[(2-chlorophenyl)methyl]-2,4-dihydropyrazolo[4,3-d]pyrimidin-7-one Traditional Name: 3-butyl-5-(2-chlorobenzyl)-2,4-dihydropyrazolo[4,3-d]pyrimidin-7-one Formula: C16H17ClN4O MolecularWeight: 316.78538

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C2C(=NN1)C(=O)N=C(N2)CC3=CC=CC=C3Cl

Isomeric SMILES

CCCCC1=C2C(=NN1)C(=O)N=C(N2)CC3=CC=CC=C3Cl

InChI

InChI=1S/C16H17ClN4O/c1-2-3-8-12-14-15(21-20-12)16(22)19-13(18-14)9-10-6-4-5-7-11(10)17/h4-7H,2-3,8-9H2,1H3,(H,20,21)(H,18,19,22)