4-[(6,7-diethoxy-4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)methyl]-N-[3-(diethylamino)propyl]benzamide

Systemtic Name: 4-[(6,7-diethoxy-4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)methyl]-N-[3-(diethylamino)propyl]benzamide Openeye Name: 4-[(6,7-diethoxy-4-oxo-2-thioxo-1H-quinazolin-3-yl)methyl]-N-[3-(diethylamino)propyl]benzamide CAS Name: 4-[(6,7-diethoxy-4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)methyl]-N-[3-(diethylamino)propyl]benzamide IUPAC Name: 4-[(6,7-diethoxy-4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)methyl]-N-[3-(diethylamino)propyl]benzamide Traditional Name: 4-[(6,7-diethoxy-4-keto-2-thioxo-1H-quinazolin-3-yl)methyl]-N-[3-(diethylamino)propyl]benzamide Formula: C27H36N4O4S MolecularWeight: 512.66414

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCNC(=O)C1=CC=C(C=C1)CN2C(=O)C3=CC(=C(C=C3NC2=S)OCC)OCC

Isomeric SMILES

CCN(CC)CCCNC(=O)C1=CC=C(C=C1)CN2C(=O)C3=CC(=C(C=C3NC2=S)OCC)OCC

InChI

InChI=1S/C27H36N4O4S/c1-5-30(6-2)15-9-14-28-25(32)20-12-10-19(11-13-20)18-31-26(33)21-16-23(34-7-3)24(35-8-4)17-22(21)29-27(31)36/h10-13,16-17H,5-9,14-15,18H2,1-4H3,(H,28,32)(H,29,36)