1-(3-chlorophenyl)-6-(methoxymethyl)-3-methyl-4-piperazin-1-yl-pyrazolo[3,4-d]pyrimidine

Systemtic Name: 1-(3-chlorophenyl)-6-(methoxymethyl)-3-methyl-4-piperazin-1-yl-pyrazolo[3,4-d]pyrimidine Openeye Name: 1-(3-chlorophenyl)-6-(methoxymethyl)-3-methyl-4-piperazin-1-yl-pyrazolo[3,4-d]pyrimidine CAS Name: 1-(3-chlorophenyl)-6-(methoxymethyl)-3-methyl-4-(1-piperazinyl)pyrazolo[3,4-d]pyrimidine IUPAC Name: 1-(3-chlorophenyl)-6-(methoxymethyl)-3-methyl-4-piperazin-1-ylpyrazolo[3,4-d]pyrimidine Traditional Name: 1-(3-chlorophenyl)-6-(methoxymethyl)-3-methyl-4-piperazino-pyrazolo[3,4-d]pyrimidine Formula: C18H21ClN6O MolecularWeight: 372.85194

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C(=NC(=N2)COC)N3CCNCC3)C4=CC(=CC=C4)Cl

Isomeric SMILES

CC1=NN(C2=C1C(=NC(=N2)COC)N3CCNCC3)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C18H21ClN6O/c1-12-16-17(24-8-6-20-7-9-24)21-15(11-26-2)22-18(16)25(23-12)14-5-3-4-13(19)10-14/h3-5,10,20H,6-9,11H2,1-2H3