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

Systemtic Name: methyl 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-oxidanyl-4-phenyl-6-propan-2-yl-2-sulfanylidene-1,3-diazinane-5-carboxylate Openeye Name: methyl 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-hydroxy-6-isopropyl-4-phenyl-2-thioxo-hexahydropyrimidine-5-carboxylate CAS Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-hydroxy-4-phenyl-6-propan-2-yl-2-sulfanylidene-1,3-diazinane-5-carboxylic acid methyl ester IUPAC Name: methyl 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-hydroxy-4-phenyl-6-propan-2-yl-2-sulfanylidene-1,3-diazinane-5-carboxylate Traditional Name: 1-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-hydroxy-6-isopropyl-4-phenyl-2-thioxo-hexahydropyrimidine-5-carboxylic acid methyl ester Formula: C23H26N2O5S MolecularWeight: 442.52794

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1(C(C(NC(=S)N1C2=CC3=C(C=C2)OCCO3)C4=CC=CC=C4)C(=O)OC)O

Isomeric SMILES

CC(C)C1(C(C(NC(=S)N1C2=CC3=C(C=C2)OCCO3)C4=CC=CC=C4)C(=O)OC)O

InChI

InChI=1S/C23H26N2O5S/c1-14(2)23(27)19(21(26)28-3)20(15-7-5-4-6-8-15)24-22(31)25(23)16-9-10-17-18(13-16)30-12-11-29-17/h4-10,13-14,19-20,27H,11-12H2,1-3H3,(H,24,31)