N-(4-ethylphenyl)-2-[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]propanamide

Systemtic Name: N-(4-ethylphenyl)-2-[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]propanamide Openeye Name: N-(4-ethylphenyl)-2-[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]propanamide CAS Name: N-(4-ethylphenyl)-2-[4-(1-methyl-4-pyrazolo[3,4-d]pyrimidinyl)-1-piperazinyl]propanamide IUPAC Name: N-(4-ethylphenyl)-2-[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]propanamide Traditional Name: N-(4-ethylphenyl)-2-[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazino]propionamide Formula: C21H27N7O MolecularWeight: 393.48538

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)C(C)N2CCN(CC2)C3=NC=NC4=C3C=NN4C

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)C(C)N2CCN(CC2)C3=NC=NC4=C3C=NN4C

InChI

InChI=1S/C21H27N7O/c1-4-16-5-7-17(8-6-16)25-21(29)15(2)27-9-11-28(12-10-27)20-18-13-24-26(3)19(18)22-14-23-20/h5-8,13-15H,4,9-12H2,1-3H3,(H,25,29)