ethyl 4-[5-(4-bromophenyl)furan-2-yl]-6-phenyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-[5-(4-bromophenyl)furan-2-yl]-6-phenyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 4-[5-(4-bromophenyl)-2-furyl]-6-phenyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 4-[5-(4-bromophenyl)-2-furanyl]-6-phenyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 4-[5-(4-bromophenyl)furan-2-yl]-6-phenyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 4-[5-(4-bromophenyl)-2-furyl]-6-phenyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C23H19BrN2O3S MolecularWeight: 483.37756

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=S)NC1C2=CC=C(O2)C3=CC=C(C=C3)Br)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(NC(=S)NC1C2=CC=C(O2)C3=CC=C(C=C3)Br)C4=CC=CC=C4

InChI

InChI=1S/C23H19BrN2O3S/c1-2-28-22(27)19-20(15-6-4-3-5-7-15)25-23(30)26-21(19)18-13-12-17(29-18)14-8-10-16(24)11-9-14/h3-13,21H,2H2,1H3,(H2,25,26,30)