[4-[(2-methylpropan-2-yl)oxycarbonyloxy]phenyl]methyl 6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: [4-[(2-methylpropan-2-yl)oxycarbonyloxy]phenyl]methyl 6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: (4-tert-butoxycarbonyloxyphenyl)methyl 6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylic acid [4-[(2-methylpropan-2-yl)oxy-oxomethoxy]phenyl]methyl ester IUPAC Name: [4-[(2-methylpropan-2-yl)oxycarbonyloxy]phenyl]methyl 6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid (4-tert-butoxycarbonyloxybenzyl) ester Formula: C18H22N2O5S MolecularWeight: 378.44268

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(CNC(=S)N1)C(=O)OCC2=CC=C(C=C2)OC(=O)OC(C)(C)C

Isomeric SMILES

CC1=C(CNC(=S)N1)C(=O)OCC2=CC=C(C=C2)OC(=O)OC(C)(C)C

InChI

InChI=1S/C18H22N2O5S/c1-11-14(9-19-16(26)20-11)15(21)23-10-12-5-7-13(8-6-12)24-17(22)25-18(2,3)4/h5-8H,9-10H2,1-4H3,(H2,19,20,26)