2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-7-methyl-5H-pyrrolo[2,3-d]pyrimidin-6-one

Systemtic Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-7-methyl-5H-pyrrolo[2,3-d]pyrimidin-6-one Openeye Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-7-methyl-5H-pyrrolo[2,3-d]pyrimidin-6-one CAS Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-7-methyl-5H-pyrrolo[2,3-d]pyrimidin-6-one IUPAC Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-7-methyl-5H-pyrrolo[2,3-d]pyrimidin-6-one Traditional Name: 7-methyl-2-(4-piperonylpiperazino)-5H-pyrrolo[2,3-d]pyrimidin-6-one Formula: C19H21N5O3 MolecularWeight: 367.40174

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)CC2=CN=C(N=C21)N3CCN(CC3)CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CN1C(=O)CC2=CN=C(N=C21)N3CCN(CC3)CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C19H21N5O3/c1-22-17(25)9-14-10-20-19(21-18(14)22)24-6-4-23(5-7-24)11-13-2-3-15-16(8-13)27-12-26-15/h2-3,8,10H,4-7,9,11-12H2,1H3