2-methylpropyl 5-(1,3-benzodioxol-5-yl)-7-methyl-4-oxidanylidene-2-sulfanylidene-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: 2-methylpropyl 5-(1,3-benzodioxol-5-yl)-7-methyl-4-oxidanylidene-2-sulfanylidene-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate Openeye Name: isobutyl 5-(1,3-benzodioxol-5-yl)-7-methyl-4-oxo-2-thioxo-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate CAS Name: 5-(1,3-benzodioxol-5-yl)-7-methyl-4-oxo-2-sulfanylidene-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 5-(1,3-benzodioxol-5-yl)-7-methyl-4-oxo-2-sulfanylidene-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylate Traditional Name: 5-(1,3-benzodioxol-5-yl)-4-keto-7-methyl-2-thioxo-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carboxylic acid isobutyl ester Formula: C20H21N3O5S MolecularWeight: 415.46284

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C2=C(N1)NC(=S)NC2=O)C3=CC4=C(C=C3)OCO4)C(=O)OCC(C)C

Isomeric SMILES

CC1=C(C(C2=C(N1)NC(=S)NC2=O)C3=CC4=C(C=C3)OCO4)C(=O)OCC(C)C

InChI

InChI=1S/C20H21N3O5S/c1-9(2)7-26-19(25)14-10(3)21-17-16(18(24)23-20(29)22-17)15(14)11-4-5-12-13(6-11)28-8-27-12/h4-6,9,15H,7-8H2,1-3H3,(H3,21,22,23,24,29)