methyl 3-[4-oxidanylidene-2-[(2S)-1-oxidanylidene-1-(propylamino)propan-2-yl]sulfanyl-quinazolin-3-yl]propanoate

Systemtic Name: methyl 3-[4-oxidanylidene-2-[(2S)-1-oxidanylidene-1-(propylamino)propan-2-yl]sulfanyl-quinazolin-3-yl]propanoate Openeye Name: methyl 3-[2-[(1S)-1-methyl-2-oxo-2-(propylamino)ethyl]sulfanyl-4-oxo-quinazolin-3-yl]propanoate CAS Name: 3-[4-oxo-2-[[(2S)-1-oxo-1-(propylamino)propan-2-yl]thio]-3-quinazolinyl]propanoic acid methyl ester IUPAC Name: methyl 3-[4-oxo-2-[(2S)-1-oxo-1-(propylamino)propan-2-yl]sulfanylquinazolin-3-yl]propanoate Traditional Name: 3-[4-keto-2-[[(1S)-2-keto-1-methyl-2-(propylamino)ethyl]thio]quinazolin-3-yl]propionic acid methyl ester Formula: C18H23N3O4S MolecularWeight: 377.45792

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C(C)SC1=NC2=CC=CC=C2C(=O)N1CCC(=O)OC

Isomeric SMILES

CCCNC(=O)[C@H](C)SC1=NC2=CC=CC=C2C(=O)N1CCC(=O)OC

InChI

InChI=1S/C18H23N3O4S/c1-4-10-19-16(23)12(2)26-18-20-14-8-6-5-7-13(14)17(24)21(18)11-9-15(22)25-3/h5-8,12H,4,9-11H2,1-3H3,(H,19,23)/t12-/m0/s1