methyl 2-[2-(3-methyl-4-oxidanylidene-benzo[g]quinazolin-2-yl)sulfanylethanoylamino]ethanoate

Systemtic Name: methyl 2-[2-(3-methyl-4-oxidanylidene-benzo[g]quinazolin-2-yl)sulfanylethanoylamino]ethanoate Openeye Name: methyl 2-[[2-(3-methyl-4-oxo-benzo[g]quinazolin-2-yl)sulfanylacetyl]amino]acetate CAS Name: 2-[[2-[(3-methyl-4-oxo-2-benzo[g]quinazolinyl)thio]-1-oxoethyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[[2-(3-methyl-4-oxobenzo[g]quinazolin-2-yl)sulfanylacetyl]amino]acetate Traditional Name: 2-[[2-[(4-keto-3-methyl-benzo[g]quinazolin-2-yl)thio]acetyl]amino]acetic acid methyl ester Formula: C18H17N3O4S MolecularWeight: 371.41028

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC3=CC=CC=C3C=C2N=C1SCC(=O)NCC(=O)OC

Isomeric SMILES

CN1C(=O)C2=CC3=CC=CC=C3C=C2N=C1SCC(=O)NCC(=O)OC

InChI

InChI=1S/C18H17N3O4S/c1-21-17(24)13-7-11-5-3-4-6-12(11)8-14(13)20-18(21)26-10-15(22)19-9-16(23)25-2/h3-8H,9-10H2,1-2H3,(H,19,22)