1-[4-[2-azanyl-6-(1,3-benzodioxol-5-yl)pyrido[3,2-d]pyrimidin-4-yl]piperazin-1-yl]ethanone

Systemtic Name: 1-[4-[2-azanyl-6-(1,3-benzodioxol-5-yl)pyrido[3,2-d]pyrimidin-4-yl]piperazin-1-yl]ethanone Openeye Name: 1-[4-[2-amino-6-(1,3-benzodioxol-5-yl)pyrido[3,2-d]pyrimidin-4-yl]piperazin-1-yl]ethanone CAS Name: 1-[4-[2-amino-6-(1,3-benzodioxol-5-yl)-4-pyrido[3,2-d]pyrimidinyl]-1-piperazinyl]ethanone IUPAC Name: 1-[4-[2-amino-6-(1,3-benzodioxol-5-yl)pyrido[3,2-d]pyrimidin-4-yl]piperazin-1-yl]ethanone Traditional Name: 1-[4-[2-amino-6-(1,3-benzodioxol-5-yl)pyrido[3,2-d]pyrimidin-4-yl]piperazino]ethanone Formula: C20H20N6O3 MolecularWeight: 392.4112

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C2=NC(=NC3=C2N=C(C=C3)C4=CC5=C(C=C4)OCO5)N

Isomeric SMILES

CC(=O)N1CCN(CC1)C2=NC(=NC3=C2N=C(C=C3)C4=CC5=C(C=C4)OCO5)N

InChI

InChI=1S/C20H20N6O3/c1-12(27)25-6-8-26(9-7-25)19-18-15(23-20(21)24-19)4-3-14(22-18)13-2-5-16-17(10-13)29-11-28-16/h2-5,10H,6-9,11H2,1H3,(H2,21,23,24)