methyl 2-(2-chloranylprop-2-enylsulfanyl)-4-oxidanylidene-3-[(2R)-2-oxidanylpropyl]quinazoline-7-carboxylate

Systemtic Name: methyl 2-(2-chloranylprop-2-enylsulfanyl)-4-oxidanylidene-3-[(2R)-2-oxidanylpropyl]quinazoline-7-carboxylate Openeye Name: methyl 2-(2-chloroallylsulfanyl)-3-[(2R)-2-hydroxypropyl]-4-oxo-quinazoline-7-carboxylate CAS Name: 2-(2-chloroprop-2-enylthio)-3-[(2R)-2-hydroxypropyl]-4-oxo-7-quinazolinecarboxylic acid methyl ester IUPAC Name: methyl 2-(2-chloroprop-2-enylsulfanyl)-3-[(2R)-2-hydroxypropyl]-4-oxoquinazoline-7-carboxylate Traditional Name: 2-(2-chloroallylthio)-3-[(2R)-2-hydroxypropyl]-4-keto-quinazoline-7-carboxylic acid methyl ester Formula: C16H17ClN2O4S MolecularWeight: 368.83518

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1C(=O)C2=C(C=C(C=C2)C(=O)OC)N=C1SCC(=C)Cl)O

Isomeric SMILES

C[C@H](CN1C(=O)C2=C(C=C(C=C2)C(=O)OC)N=C1SCC(=C)Cl)O

InChI

InChI=1S/C16H17ClN2O4S/c1-9(17)8-24-16-18-13-6-11(15(22)23-3)4-5-12(13)14(21)19(16)7-10(2)20/h4-6,10,20H,1,7-8H2,2-3H3/t10-/m1/s1