butyl 2-(3-methyl-4-oxidanylidene-benzo[g]quinazolin-2-yl)sulfanylethanoate

Systemtic Name: butyl 2-(3-methyl-4-oxidanylidene-benzo[g]quinazolin-2-yl)sulfanylethanoate Openeye Name: butyl 2-(3-methyl-4-oxo-benzo[g]quinazolin-2-yl)sulfanylacetate CAS Name: 2-[(3-methyl-4-oxo-2-benzo[g]quinazolinyl)thio]acetic acid butyl ester IUPAC Name: butyl 2-(3-methyl-4-oxobenzo[g]quinazolin-2-yl)sulfanylacetate Traditional Name: 2-[(4-keto-3-methyl-benzo[g]quinazolin-2-yl)thio]acetic acid butyl ester Formula: C19H20N2O3S MolecularWeight: 356.4387

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)CSC1=NC2=CC3=CC=CC=C3C=C2C(=O)N1C

Isomeric SMILES

CCCCOC(=O)CSC1=NC2=CC3=CC=CC=C3C=C2C(=O)N1C

InChI

InChI=1S/C19H20N2O3S/c1-3-4-9-24-17(22)12-25-19-20-16-11-14-8-6-5-7-13(14)10-15(16)18(23)21(19)2/h5-8,10-11H,3-4,9,12H2,1-2H3