methyl 6-(carbamothioylamino)-2-methyl-3-(5-oxidanylidene-4,7-dihydro-1H-furo[3,4-b]pyridin-4-yl)benzoate

Systemtic Name: methyl 6-(carbamothioylamino)-2-methyl-3-(5-oxidanylidene-4,7-dihydro-1H-furo[3,4-b]pyridin-4-yl)benzoate Openeye Name: methyl 6-(carbamothioylamino)-2-methyl-3-(5-oxo-4,7-dihydro-1H-furo[3,4-b]pyridin-4-yl)benzoate CAS Name: 6-(carbamothioylamino)-2-methyl-3-(5-oxo-4,7-dihydro-1H-furo[3,4-b]pyridin-4-yl)benzoic acid methyl ester IUPAC Name: methyl 6-(carbamothioylamino)-2-methyl-3-(5-oxo-4,7-dihydro-1H-furo[3,4-b]pyridin-4-yl)benzoate Traditional Name: 3-(5-keto-4,7-dihydro-1H-furo[3,4-b]pyridin-4-yl)-2-methyl-6-thioureido-benzoic acid methyl ester Formula: C17H17N3O4S MolecularWeight: 359.39958

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1C(=O)OC)NC(=S)N)C2C=CNC3=C2C(=O)OC3

Isomeric SMILES

CC1=C(C=CC(=C1C(=O)OC)NC(=S)N)C2C=CNC3=C2C(=O)OC3

InChI

InChI=1S/C17H17N3O4S/c1-8-9(10-5-6-19-12-7-24-16(22)14(10)12)3-4-11(20-17(18)25)13(8)15(21)23-2/h3-6,10,19H,7H2,1-2H3,(H3,18,20,25)