2-[5-oxidanylidene-2-[4-(phenylmethyl)piperazin-1-yl]-7H-pyrrolo[3,4-d]pyrimidin-6-yl]ethanamide

Systemtic Name: 2-[5-oxidanylidene-2-[4-(phenylmethyl)piperazin-1-yl]-7H-pyrrolo[3,4-d]pyrimidin-6-yl]ethanamide Openeye Name: 2-[2-(4-benzylpiperazin-1-yl)-5-oxo-7H-pyrrolo[3,4-d]pyrimidin-6-yl]acetamide CAS Name: 2-[5-oxo-2-[4-(phenylmethyl)-1-piperazinyl]-7H-pyrrolo[3,4-d]pyrimidin-6-yl]acetamide IUPAC Name: 2-[2-(4-benzylpiperazin-1-yl)-5-oxo-7H-pyrrolo[3,4-d]pyrimidin-6-yl]acetamide Traditional Name: 2-[2-(4-benzylpiperazino)-5-keto-7H-pyrrolo[3,4-d]pyrimidin-6-yl]acetamide Formula: C19H22N6O2 MolecularWeight: 366.41698

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C3=NC=C4C(=N3)CN(C4=O)CC(=O)N

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C3=NC=C4C(=N3)CN(C4=O)CC(=O)N

InChI

InChI=1S/C19H22N6O2/c20-17(26)13-25-12-16-15(18(25)27)10-21-19(22-16)24-8-6-23(7-9-24)11-14-4-2-1-3-5-14/h1-5,10H,6-9,11-13H2,(H2,20,26)