6,7-diethoxy-3-[3-oxidanylidene-3-(4-pyridin-2-ylpiperazin-1-yl)propyl]-2-sulfanylidene-1H-quinazolin-4-one

Systemtic Name: 6,7-diethoxy-3-[3-oxidanylidene-3-(4-pyridin-2-ylpiperazin-1-yl)propyl]-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 6,7-diethoxy-3-[3-oxo-3-[4-(2-pyridyl)piperazin-1-yl]propyl]-2-thioxo-1H-quinazolin-4-one CAS Name: 6,7-diethoxy-3-[3-oxo-3-[4-(2-pyridinyl)-1-piperazinyl]propyl]-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 6,7-diethoxy-3-[3-oxo-3-(4-pyridin-2-ylpiperazin-1-yl)propyl]-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 6,7-diethoxy-3-[3-keto-3-[4-(2-pyridyl)piperazino]propyl]-2-thioxo-1H-quinazolin-4-one Formula: C24H29N5O4S MolecularWeight: 483.58316

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)C(=O)N(C(=S)N2)CCC(=O)N3CCN(CC3)C4=CC=CC=N4)OCC

Isomeric SMILES

CCOC1=C(C=C2C(=C1)C(=O)N(C(=S)N2)CCC(=O)N3CCN(CC3)C4=CC=CC=N4)OCC

InChI

InChI=1S/C24H29N5O4S/c1-3-32-19-15-17-18(16-20(19)33-4-2)26-24(34)29(23(17)31)10-8-22(30)28-13-11-27(12-14-28)21-7-5-6-9-25-21/h5-7,9,15-16H,3-4,8,10-14H2,1-2H3,(H,26,34)