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

Systemtic Name: methyl (6R)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-methyl-6-(2-prop-2-enoxyphenyl)-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Openeye Name: methyl (6R)-6-(2-allyloxyphenyl)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-methyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylate CAS Name: (6R)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-methyl-6-(2-prop-2-enoxyphenyl)-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylic acid methyl ester IUPAC Name: methyl (6R)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-methyl-6-(2-prop-2-enoxyphenyl)-2-sulfanylidene-1,6-dihydropyrimidine-5-carboxylate Traditional Name: (6R)-6-(2-allyloxyphenyl)-3-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-methyl-2-thioxo-1,6-dihydropyrimidine-5-carboxylic acid methyl ester Formula: C24H24N2O5S MolecularWeight: 452.52276

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=S)N1C2=CC3=C(C=C2)OCCO3)C4=CC=CC=C4OCC=C)C(=O)OC

Isomeric SMILES

CC1=C([C@H](NC(=S)N1C2=CC3=C(C=C2)OCCO3)C4=CC=CC=C4OCC=C)C(=O)OC

InChI

InChI=1S/C24H24N2O5S/c1-4-11-29-18-8-6-5-7-17(18)22-21(23(27)28-3)15(2)26(24(32)25-22)16-9-10-19-20(14-16)31-13-12-30-19/h4-10,14,22H,1,11-13H2,2-3H3,(H,25,32)/t22-/m1/s1