propan-2-yl 4-(5-bromanyl-2-ethoxy-phenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: propan-2-yl 4-(5-bromanyl-2-ethoxy-phenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: isopropyl 4-(5-bromo-2-ethoxy-phenyl)-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 4-(5-bromo-2-ethoxyphenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 4-(5-bromo-2-ethoxyphenyl)-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 4-(5-bromo-2-ethoxy-phenyl)-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid isopropyl ester Formula: C17H21BrN2O3S MolecularWeight: 413.32924

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)Br)C2C(=C(NC(=S)N2)C)C(=O)OC(C)C

Isomeric SMILES

CCOC1=C(C=C(C=C1)Br)C2C(=C(NC(=S)N2)C)C(=O)OC(C)C

InChI

InChI=1S/C17H21BrN2O3S/c1-5-22-13-7-6-11(18)8-12(13)15-14(16(21)23-9(2)3)10(4)19-17(24)20-15/h6-9,15H,5H2,1-4H3,(H2,19,20,24)