5,5-diethyl-2-[(3-ethyl-4-oxidanylidene-quinazolin-2-yl)sulfanylmethyl]-1,6-dihydrobenzo[h]quinazolin-4-one

Systemtic Name: 5,5-diethyl-2-[(3-ethyl-4-oxidanylidene-quinazolin-2-yl)sulfanylmethyl]-1,6-dihydrobenzo[h]quinazolin-4-one Openeye Name: 5,5-diethyl-2-[(3-ethyl-4-oxo-quinazolin-2-yl)sulfanylmethyl]-1,6-dihydrobenzo[h]quinazolin-4-one CAS Name: 5,5-diethyl-2-[[(3-ethyl-4-oxo-2-quinazolinyl)thio]methyl]-1,6-dihydrobenzo[h]quinazolin-4-one IUPAC Name: 5,5-diethyl-2-[(3-ethyl-4-oxoquinazolin-2-yl)sulfanylmethyl]-1,6-dihydrobenzo[h]quinazolin-4-one Traditional Name: 5,5-diethyl-2-[[(3-ethyl-4-keto-quinazolin-2-yl)thio]methyl]-1,6-dihydrobenzo[h]quinazolin-4-one Formula: C27H28N4O2S MolecularWeight: 472.60182

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CC2=CC=CC=C2C3=C1C(=O)N=C(N3)CSC4=NC5=CC=CC=C5C(=O)N4CC)CC

Isomeric SMILES

CCC1(CC2=CC=CC=C2C3=C1C(=O)N=C(N3)CSC4=NC5=CC=CC=C5C(=O)N4CC)CC

InChI

InChI=1S/C27H28N4O2S/c1-4-27(5-2)15-17-11-7-8-12-18(17)23-22(27)24(32)30-21(29-23)16-34-26-28-20-14-10-9-13-19(20)25(33)31(26)6-3/h7-14H,4-6,15-16H2,1-3H3,(H,29,30,32)