propan-2-yl 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-methyl-6-phenyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate

Systemtic Name: propan-2-yl 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-methyl-6-phenyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: isopropyl 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-methyl-6-phenyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-methyl-6-phenyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-methyl-6-phenyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Traditional Name: 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-methyl-6-phenyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylic acid isopropyl ester Formula: C23H24N2O4S MolecularWeight: 424.51266

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=S)N1C2=CC3=C(C=C2)OCCO3)C4=CC=CC=C4)C(=O)OC(C)C

Isomeric SMILES

CC1=C(C(NC(=S)N1C2=CC3=C(C=C2)OCCO3)C4=CC=CC=C4)C(=O)OC(C)C

InChI

InChI=1S/C23H24N2O4S/c1-14(2)29-22(26)20-15(3)25(17-9-10-18-19(13-17)28-12-11-27-18)23(30)24-21(20)16-7-5-4-6-8-16/h4-10,13-14,21H,11-12H2,1-3H3,(H,24,30)