methyl 5-oxidanylidene-3-(oxolan-2-ylmethylcarbamoyl)-1-sulfanylidene-4H-[1,3]thiazolo[3,4-a]quinazoline-8-carboxylate

Systemtic Name: methyl 5-oxidanylidene-3-(oxolan-2-ylmethylcarbamoyl)-1-sulfanylidene-4H-[1,3]thiazolo[3,4-a]quinazoline-8-carboxylate Openeye Name: methyl 5-oxo-3-(tetrahydrofuran-2-ylmethylcarbamoyl)-1-thioxo-4H-thiazolo[3,4-a]quinazoline-8-carboxylate CAS Name: 5-oxo-3-[oxo-(2-oxolanylmethylamino)methyl]-1-sulfanylidene-4H-thiazolo[3,4-a]quinazoline-8-carboxylic acid methyl ester IUPAC Name: methyl 5-oxo-3-(oxolan-2-ylmethylcarbamoyl)-1-sulfanylidene-4H-[1,3]thiazolo[3,4-a]quinazoline-8-carboxylate Traditional Name: 5-keto-3-(tetrahydrofurfurylcarbamoyl)-1-thioxo-4H-thiazolo[3,4-a]quinazoline-8-carboxylic acid methyl ester Formula: C18H17N3O5S2 MolecularWeight: 419.47468

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)C(=O)NC3=C(SC(=S)N23)C(=O)NCC4CCCO4

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)C(=O)NC3=C(SC(=S)N23)C(=O)NCC4CCCO4

InChI

InChI=1S/C18H17N3O5S2/c1-25-17(24)9-4-5-11-12(7-9)21-14(20-15(11)22)13(28-18(21)27)16(23)19-8-10-3-2-6-26-10/h4-5,7,10H,2-3,6,8H2,1H3,(H,19,23)(H,20,22)