ethyl 2-[(5-ethyl-5-methyl-4-oxidanylidene-1,6-dihydrobenzo[h]quinazolin-2-yl)sulfanyl]ethanoate

Systemtic Name: ethyl 2-[(5-ethyl-5-methyl-4-oxidanylidene-1,6-dihydrobenzo[h]quinazolin-2-yl)sulfanyl]ethanoate Openeye Name: ethyl 2-[(5-ethyl-5-methyl-4-oxo-1,6-dihydrobenzo[h]quinazolin-2-yl)sulfanyl]acetate CAS Name: 2-[(5-ethyl-5-methyl-4-oxo-1,6-dihydrobenzo[h]quinazolin-2-yl)thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[(5-ethyl-5-methyl-4-oxo-1,6-dihydrobenzo[h]quinazolin-2-yl)sulfanyl]acetate Traditional Name: 2-[(5-ethyl-4-keto-5-methyl-1,6-dihydrobenzo[h]quinazolin-2-yl)thio]acetic acid ethyl ester Formula: C19H22N2O3S MolecularWeight: 358.45458

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CC2=CC=CC=C2C3=C1C(=O)N=C(N3)SCC(=O)OCC)C

Isomeric SMILES

CCC1(CC2=CC=CC=C2C3=C1C(=O)N=C(N3)SCC(=O)OCC)C

InChI

InChI=1S/C19H22N2O3S/c1-4-19(3)10-12-8-6-7-9-13(12)16-15(19)17(23)21-18(20-16)25-11-14(22)24-5-2/h6-9H,4-5,10-11H2,1-3H3,(H,20,21,23)