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

Systemtic Name: methyl 3-(3-methoxypropyl)-4-oxidanylidene-2-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]sulfanyl-quinazoline-7-carboxylate Openeye Name: methyl 2-[2-(isopropylamino)-2-oxo-ethyl]sulfanyl-3-(3-methoxypropyl)-4-oxo-quinazoline-7-carboxylate CAS Name: 3-(3-methoxypropyl)-4-oxo-2-[[2-oxo-2-(propan-2-ylamino)ethyl]thio]-7-quinazolinecarboxylic acid methyl ester IUPAC Name: methyl 3-(3-methoxypropyl)-4-oxo-2-[2-oxo-2-(propan-2-ylamino)ethyl]sulfanylquinazoline-7-carboxylate Traditional Name: 2-[[2-(isopropylamino)-2-keto-ethyl]thio]-4-keto-3-(3-methoxypropyl)quinazoline-7-carboxylic acid methyl ester Formula: C19H25N3O5S MolecularWeight: 407.4839

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H25N3O5S/c1-12(2)20-16(23)11-28-19-21-15-10-13(18(25)27-4)6-7-14(15)17(24)22(19)8-5-9-26-3/h6-7,10,12H,5,8-9,11H2,1-4H3,(H,20,23)