6,7-dimethoxy-3-[3-oxidanylidene-3-(3-oxidanylidenepiperazin-1-yl)propyl]quinazolin-4-one

Systemtic Name: 6,7-dimethoxy-3-[3-oxidanylidene-3-(3-oxidanylidenepiperazin-1-yl)propyl]quinazolin-4-one Openeye Name: 6,7-dimethoxy-3-[3-oxo-3-(3-oxopiperazin-1-yl)propyl]quinazolin-4-one CAS Name: 6,7-dimethoxy-3-[3-oxo-3-(3-oxo-1-piperazinyl)propyl]-4-quinazolinone IUPAC Name: 6,7-dimethoxy-3-[3-oxo-3-(3-oxopiperazin-1-yl)propyl]quinazolin-4-one Traditional Name: 3-[3-keto-3-(3-ketopiperazino)propyl]-6,7-dimethoxy-quinazolin-4-one Formula: C17H20N4O5 MolecularWeight: 360.3645

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=O)N(C=N2)CCC(=O)N3CCNC(=O)C3)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=O)N(C=N2)CCC(=O)N3CCNC(=O)C3)OC

InChI

InChI=1S/C17H20N4O5/c1-25-13-7-11-12(8-14(13)26-2)19-10-21(17(11)24)5-3-16(23)20-6-4-18-15(22)9-20/h7-8,10H,3-6,9H2,1-2H3,(H,18,22)