methyl 3-(3-methoxypropyl)-2-[2-(methylamino)-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-quinazoline-7-carboxylate

Systemtic Name: methyl 3-(3-methoxypropyl)-2-[2-(methylamino)-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-quinazoline-7-carboxylate Openeye Name: methyl 3-(3-methoxypropyl)-2-[2-(methylamino)-2-oxo-ethyl]sulfanyl-4-oxo-quinazoline-7-carboxylate CAS Name: 3-(3-methoxypropyl)-2-[[2-(methylamino)-2-oxoethyl]thio]-4-oxo-7-quinazolinecarboxylic acid methyl ester IUPAC Name: methyl 3-(3-methoxypropyl)-2-[2-(methylamino)-2-oxoethyl]sulfanyl-4-oxoquinazoline-7-carboxylate Traditional Name: 4-keto-2-[[2-keto-2-(methylamino)ethyl]thio]-3-(3-methoxypropyl)quinazoline-7-carboxylic acid methyl ester Formula: C17H21N3O5S MolecularWeight: 379.43074

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)CSC1=NC2=C(C=CC(=C2)C(=O)OC)C(=O)N1CCCOC

Isomeric SMILES

CNC(=O)CSC1=NC2=C(C=CC(=C2)C(=O)OC)C(=O)N1CCCOC

InChI

InChI=1S/C17H21N3O5S/c1-18-14(21)10-26-17-19-13-9-11(16(23)25-3)5-6-12(13)15(22)20(17)7-4-8-24-2/h5-6,9H,4,7-8,10H2,1-3H3,(H,18,21)