ethyl 4-oxidanylidene-1,3-diphenyl-6-(2-phenylazanylethylamino)-2-sulfanylidene-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-oxidanylidene-1,3-diphenyl-6-(2-phenylazanylethylamino)-2-sulfanylidene-pyrimidine-5-carboxylate Openeye Name: ethyl 4-(2-anilinoethylamino)-6-oxo-1,3-diphenyl-2-thioxo-pyrimidine-5-carboxylate CAS Name: 4-(2-anilinoethylamino)-6-oxo-1,3-diphenyl-2-sulfanylidene-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(2-anilinoethylamino)-6-oxo-1,3-diphenyl-2-sulfanylidenepyrimidine-5-carboxylate Traditional Name: 4-(2-anilinoethylamino)-6-keto-1,3-diphenyl-2-thioxo-pyrimidine-5-carboxylic acid ethyl ester Formula: C27H26N4O3S MolecularWeight: 486.58534

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=S)N(C1=O)C2=CC=CC=C2)C3=CC=CC=C3)NCCNC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(N(C(=S)N(C1=O)C2=CC=CC=C2)C3=CC=CC=C3)NCCNC4=CC=CC=C4

InChI

InChI=1S/C27H26N4O3S/c1-2-34-26(33)23-24(29-19-18-28-20-12-6-3-7-13-20)30(21-14-8-4-9-15-21)27(35)31(25(23)32)22-16-10-5-11-17-22/h3-17,28-29H,2,18-19H2,1H3