methyl 2-[4-oxidanylidene-2-[2-oxidanylidene-2-(propan-2-ylcarbamoylamino)ethyl]sulfanyl-quinazolin-3-yl]ethanoate

Systemtic Name: methyl 2-[4-oxidanylidene-2-[2-oxidanylidene-2-(propan-2-ylcarbamoylamino)ethyl]sulfanyl-quinazolin-3-yl]ethanoate Openeye Name: methyl 2-[2-[2-(isopropylcarbamoylamino)-2-oxo-ethyl]sulfanyl-4-oxo-quinazolin-3-yl]acetate CAS Name: 2-[4-oxo-2-[[2-oxo-2-[[oxo-(propan-2-ylamino)methyl]amino]ethyl]thio]-3-quinazolinyl]acetic acid methyl ester IUPAC Name: methyl 2-[4-oxo-2-[2-oxo-2-(propan-2-ylcarbamoylamino)ethyl]sulfanylquinazolin-3-yl]acetate Traditional Name: 2-[2-[[2-(isopropylcarbamoylamino)-2-keto-ethyl]thio]-4-keto-quinazolin-3-yl]acetic acid methyl ester Formula: C17H20N4O5S MolecularWeight: 392.4295

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NC(=O)CSC1=NC2=CC=CC=C2C(=O)N1CC(=O)OC

Isomeric SMILES

CC(C)NC(=O)NC(=O)CSC1=NC2=CC=CC=C2C(=O)N1CC(=O)OC

InChI

InChI=1S/C17H20N4O5S/c1-10(2)18-16(25)20-13(22)9-27-17-19-12-7-5-4-6-11(12)15(24)21(17)8-14(23)26-3/h4-7,10H,8-9H2,1-3H3,(H2,18,20,22,25)