methyl 2-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)sulfanylmethyl]-4-oxidanylidene-1H-quinazoline-7-carboxylate

Systemtic Name: methyl 2-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)sulfanylmethyl]-4-oxidanylidene-1H-quinazoline-7-carboxylate Openeye Name: methyl 2-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)sulfanylmethyl]-4-oxo-1H-quinazoline-7-carboxylate CAS Name: 2-[[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)thio]methyl]-4-oxo-1H-quinazoline-7-carboxylic acid methyl ester IUPAC Name: methyl 2-[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)sulfanylmethyl]-4-oxo-1H-quinazoline-7-carboxylate Traditional Name: 2-[[(5-cyclopropyl-1,3,4-oxadiazol-2-yl)thio]methyl]-4-keto-1H-quinazoline-7-carboxylic acid methyl ester Formula: C16H14N4O4S MolecularWeight: 358.37176

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)C(=O)N=C(N2)CSC3=NN=C(O3)C4CC4

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)C(=O)N=C(N2)CSC3=NN=C(O3)C4CC4

InChI

InChI=1S/C16H14N4O4S/c1-23-15(22)9-4-5-10-11(6-9)17-12(18-13(10)21)7-25-16-20-19-14(24-16)8-2-3-8/h4-6,8H,2-3,7H2,1H3,(H,17,18,21)