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

Systemtic Name: 1-[4-[2-azanyl-6-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrido[3,2-d]pyrimidin-4-yl]piperazin-1-yl]ethanone Openeye Name: 1-[4-[2-amino-6-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrido[3,2-d]pyrimidin-4-yl]piperazin-1-yl]ethanone CAS Name: 1-[4-[2-amino-6-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-pyrido[3,2-d]pyrimidinyl]-1-piperazinyl]ethanone IUPAC Name: 1-[4-[2-amino-6-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrido[3,2-d]pyrimidin-4-yl]piperazin-1-yl]ethanone Traditional Name: 1-[4-[2-amino-6-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrido[3,2-d]pyrimidin-4-yl]piperazino]ethanone Formula: C21H22N6O3 MolecularWeight: 406.43778

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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)OCCO5)N

Isomeric SMILES

CC(=O)N1CCN(CC1)C2=NC(=NC3=C2N=C(C=C3)C4=CC5=C(C=C4)OCCO5)N

InChI

InChI=1S/C21H22N6O3/c1-13(28)26-6-8-27(9-7-26)20-19-16(24-21(22)25-20)4-3-15(23-19)14-2-5-17-18(12-14)30-11-10-29-17/h2-5,12H,6-11H2,1H3,(H2,22,24,25)