6-[(3-chloranyl-4-methyl-phenyl)amino]-1,2-dihydropyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 6-[(3-chloranyl-4-methyl-phenyl)amino]-1,2-dihydropyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 6-(3-chloro-4-methyl-anilino)-1,2-dihydropyrazolo[3,4-d]pyrimidin-4-one CAS Name: 6-(3-chloro-4-methylanilino)-1,2-dihydropyrazolo[3,4-d]pyrimidin-4-one IUPAC Name: 6-(3-chloro-4-methylanilino)-1,2-dihydropyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 6-(3-chloro-4-methyl-anilino)-1,2-dihydropyrazolo[3,4-d]pyrimidin-4-one Formula: C12H10ClN5O MolecularWeight: 275.6937

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC2=NC(=O)C3=CNNC3=N2)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC2=NC(=O)C3=CNNC3=N2)Cl

InChI

InChI=1S/C12H10ClN5O/c1-6-2-3-7(4-9(6)13)15-12-16-10-8(5-14-18-10)11(19)17-12/h2-5H,1H3,(H3,14,15,16,17,18,19)