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

Systemtic Name: prop-2-enyl 3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-methyl-6-phenyl-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: allyl 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 prop-2-enyl ester IUPAC Name: prop-2-enyl 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 allyl ester Formula: C23H22N2O4S MolecularWeight: 422.49678

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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)OCC=C

Isomeric SMILES

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

InChI

InChI=1S/C23H22N2O4S/c1-3-11-29-22(26)20-15(2)25(17-9-10-18-19(14-17)28-13-12-27-18)23(30)24-21(20)16-7-5-4-6-8-16/h3-10,14,21H,1,11-13H2,2H3,(H,24,30)