4-(4-butyl-1,4-diazepan-1-yl)-6-(2-methylpropyl)-1-phenyl-pyrazolo[3,4-d]pyrimidine

Systemtic Name: 4-(4-butyl-1,4-diazepan-1-yl)-6-(2-methylpropyl)-1-phenyl-pyrazolo[3,4-d]pyrimidine Openeye Name: 4-(4-butyl-1,4-diazepan-1-yl)-6-isobutyl-1-phenyl-pyrazolo[3,4-d]pyrimidine CAS Name: 4-(4-butyl-1,4-diazepan-1-yl)-6-(2-methylpropyl)-1-phenylpyrazolo[3,4-d]pyrimidine IUPAC Name: 4-(4-butyl-1,4-diazepan-1-yl)-6-(2-methylpropyl)-1-phenylpyrazolo[3,4-d]pyrimidine Traditional Name: 4-(4-butyl-1,4-diazepan-1-yl)-6-isobutyl-1-phenyl-pyrazolo[3,4-d]pyrimidine Formula: C24H34N6 MolecularWeight: 406.56696

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CCCN(CC1)C2=NC(=NC3=C2C=NN3C4=CC=CC=C4)CC(C)C

Isomeric SMILES

CCCCN1CCCN(CC1)C2=NC(=NC3=C2C=NN3C4=CC=CC=C4)CC(C)C

InChI

InChI=1S/C24H34N6/c1-4-5-12-28-13-9-14-29(16-15-28)23-21-18-25-30(20-10-7-6-8-11-20)24(21)27-22(26-23)17-19(2)3/h6-8,10-11,18-19H,4-5,9,12-17H2,1-3H3