N-butyl-1-(3-chloranyl-4-methyl-phenyl)-N-ethyl-pyrazolo[3,4-d]pyrimidin-4-amine

Systemtic Name: N-butyl-1-(3-chloranyl-4-methyl-phenyl)-N-ethyl-pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: N-butyl-1-(3-chloro-4-methyl-phenyl)-N-ethyl-pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: N-butyl-1-(3-chloro-4-methylphenyl)-N-ethyl-4-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: N-butyl-1-(3-chloro-4-methylphenyl)-N-ethylpyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: butyl-[1-(3-chloro-4-methyl-phenyl)pyrazolo[3,4-d]pyrimidin-4-yl]-ethyl-amine Formula: C18H22ClN5 MolecularWeight: 343.85378

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC)C1=NC=NC2=C1C=NN2C3=CC(=C(C=C3)C)Cl

Isomeric SMILES

CCCCN(CC)C1=NC=NC2=C1C=NN2C3=CC(=C(C=C3)C)Cl

InChI

InChI=1S/C18H22ClN5/c1-4-6-9-23(5-2)17-15-11-22-24(18(15)21-12-20-17)14-8-7-13(3)16(19)10-14/h7-8,10-12H,4-6,9H2,1-3H3