methyl 3-methyl-2-(1,2-oxazol-3-ylmethylsulfanyl)-4-oxidanylidene-quinazoline-7-carboxylate

Systemtic Name: methyl 3-methyl-2-(1,2-oxazol-3-ylmethylsulfanyl)-4-oxidanylidene-quinazoline-7-carboxylate Openeye Name: methyl 2-(isoxazol-3-ylmethylsulfanyl)-3-methyl-4-oxo-quinazoline-7-carboxylate CAS Name: 2-(3-isoxazolylmethylthio)-3-methyl-4-oxo-7-quinazolinecarboxylic acid methyl ester IUPAC Name: methyl 3-methyl-2-(1,2-oxazol-3-ylmethylsulfanyl)-4-oxoquinazoline-7-carboxylate Traditional Name: 2-(isoxazol-3-ylmethylthio)-4-keto-3-methyl-quinazoline-7-carboxylic acid methyl ester Formula: C15H13N3O4S MolecularWeight: 331.34642

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(C=C(C=C2)C(=O)OC)N=C1SCC3=NOC=C3

Isomeric SMILES

CN1C(=O)C2=C(C=C(C=C2)C(=O)OC)N=C1SCC3=NOC=C3

InChI

InChI=1S/C15H13N3O4S/c1-18-13(19)11-4-3-9(14(20)21-2)7-12(11)16-15(18)23-8-10-5-6-22-17-10/h3-7H,8H2,1-2H3