methyl 2-[2-[1-[(5-methyl-1,2-oxazol-3-yl)amino]-1-oxidanylidene-butan-2-yl]sulfanyl-4-oxidanylidene-quinazolin-3-yl]ethanoate

Systemtic Name: methyl 2-[2-[1-[(5-methyl-1,2-oxazol-3-yl)amino]-1-oxidanylidene-butan-2-yl]sulfanyl-4-oxidanylidene-quinazolin-3-yl]ethanoate Openeye Name: methyl 2-[2-[1-[(5-methylisoxazol-3-yl)carbamoyl]propylsulfanyl]-4-oxo-quinazolin-3-yl]acetate CAS Name: 2-[2-[[1-[(5-methyl-3-isoxazolyl)amino]-1-oxobutan-2-yl]thio]-4-oxo-3-quinazolinyl]acetic acid methyl ester IUPAC Name: methyl 2-[2-[1-[(5-methyl-1,2-oxazol-3-yl)amino]-1-oxobutan-2-yl]sulfanyl-4-oxoquinazolin-3-yl]acetate Traditional Name: 2-[4-keto-2-[1-[(5-methylisoxazol-3-yl)carbamoyl]propylthio]quinazolin-3-yl]acetic acid methyl ester Formula: C19H20N4O5S MolecularWeight: 416.4509

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=NOC(=C1)C)SC2=NC3=CC=CC=C3C(=O)N2CC(=O)OC

Isomeric SMILES

CCC(C(=O)NC1=NOC(=C1)C)SC2=NC3=CC=CC=C3C(=O)N2CC(=O)OC

InChI

InChI=1S/C19H20N4O5S/c1-4-14(17(25)21-15-9-11(2)28-22-15)29-19-20-13-8-6-5-7-12(13)18(26)23(19)10-16(24)27-3/h5-9,14H,4,10H2,1-3H3,(H,21,22,25)