5,5-diethyl-2-[(4-oxidanylidene-1H-quinazolin-2-yl)sulfanylmethyl]-1,6-dihydrobenzo[h]quinazolin-4-one

Systemtic Name: 5,5-diethyl-2-[(4-oxidanylidene-1H-quinazolin-2-yl)sulfanylmethyl]-1,6-dihydrobenzo[h]quinazolin-4-one Openeye Name: 5,5-diethyl-2-[(4-oxo-1H-quinazolin-2-yl)sulfanylmethyl]-1,6-dihydrobenzo[h]quinazolin-4-one CAS Name: 5,5-diethyl-2-[[(4-oxo-1H-quinazolin-2-yl)thio]methyl]-1,6-dihydrobenzo[h]quinazolin-4-one IUPAC Name: 5,5-diethyl-2-[(4-oxo-1H-quinazolin-2-yl)sulfanylmethyl]-1,6-dihydrobenzo[h]quinazolin-4-one Traditional Name: 5,5-diethyl-2-[[(4-keto-1H-quinazolin-2-yl)thio]methyl]-1,6-dihydrobenzo[h]quinazolin-4-one Formula: C25H24N4O2S MolecularWeight: 444.54866

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CC2=CC=CC=C2C3=C1C(=O)N=C(N3)CSC4=NC(=O)C5=CC=CC=C5N4)CC

Isomeric SMILES

CCC1(CC2=CC=CC=C2C3=C1C(=O)N=C(N3)CSC4=NC(=O)C5=CC=CC=C5N4)CC

InChI

InChI=1S/C25H24N4O2S/c1-3-25(4-2)13-15-9-5-6-10-16(15)21-20(25)23(31)28-19(27-21)14-32-24-26-18-12-8-7-11-17(18)22(30)29-24/h5-12H,3-4,13-14H2,1-2H3,(H,26,29,30)(H,27,28,31)