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

Systemtic Name: ethyl 4-oxidanylidene-1,3-diphenyl-2-sulfanylidene-6-(3,4,5-trimethoxyphenyl)carbonylsulfanyl-pyrimidine-5-carboxylate Openeye Name: ethyl 4-oxo-1,3-diphenyl-2-thioxo-6-(3,4,5-trimethoxybenzoyl)sulfanyl-pyrimidine-5-carboxylate CAS Name: 4-oxo-6-[[oxo-(3,4,5-trimethoxyphenyl)methyl]thio]-1,3-diphenyl-2-sulfanylidene-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-oxo-1,3-diphenyl-2-sulfanylidene-6-(3,4,5-trimethoxybenzoyl)sulfanylpyrimidine-5-carboxylate Traditional Name: 4-keto-1,3-diphenyl-2-thioxo-6-[(3,4,5-trimethoxybenzoyl)thio]pyrimidine-5-carboxylic acid ethyl ester Formula: C29H26N2O7S2 MolecularWeight: 578.65594

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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)SC(=O)C4=CC(=C(C(=C4)OC)OC)OC

Isomeric SMILES

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

InChI

InChI=1S/C29H26N2O7S2/c1-5-38-27(33)23-25(32)30(19-12-8-6-9-13-19)29(39)31(20-14-10-7-11-15-20)26(23)40-28(34)18-16-21(35-2)24(37-4)22(17-18)36-3/h6-17H,5H2,1-4H3