6,7-diethoxy-3-[5-oxidanylidene-5-(4-phenylpiperazin-1-yl)pentyl]-1H-quinazoline-2,4-dione

Systemtic Name: 6,7-diethoxy-3-[5-oxidanylidene-5-(4-phenylpiperazin-1-yl)pentyl]-1H-quinazoline-2,4-dione Openeye Name: 6,7-diethoxy-3-[5-oxo-5-(4-phenylpiperazin-1-yl)pentyl]-1H-quinazoline-2,4-dione CAS Name: 6,7-diethoxy-3-[5-oxo-5-(4-phenyl-1-piperazinyl)pentyl]-1H-quinazoline-2,4-dione IUPAC Name: 6,7-diethoxy-3-[5-oxo-5-(4-phenylpiperazin-1-yl)pentyl]-1H-quinazoline-2,4-dione Traditional Name: 6,7-diethoxy-3-[5-keto-5-(4-phenylpiperazino)pentyl]-1H-quinazoline-2,4-quinone Formula: C27H34N4O5 MolecularWeight: 494.58266

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)C(=O)N(C(=O)N2)CCCCC(=O)N3CCN(CC3)C4=CC=CC=C4)OCC

Isomeric SMILES

CCOC1=C(C=C2C(=C1)C(=O)N(C(=O)N2)CCCCC(=O)N3CCN(CC3)C4=CC=CC=C4)OCC

InChI

InChI=1S/C27H34N4O5/c1-3-35-23-18-21-22(19-24(23)36-4-2)28-27(34)31(26(21)33)13-9-8-12-25(32)30-16-14-29(15-17-30)20-10-6-5-7-11-20/h5-7,10-11,18-19H,3-4,8-9,12-17H2,1-2H3,(H,28,34)