ethyl 2-[2-[(3,4-dimethylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-6-methyl-1,4-diphenyl-4H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 2-[2-[(3,4-dimethylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-6-methyl-1,4-diphenyl-4H-pyrimidine-5-carboxylate Openeye Name: ethyl 2-[2-(3,4-dimethylanilino)-2-oxo-ethyl]sulfanyl-6-methyl-1,4-diphenyl-4H-pyrimidine-5-carboxylate CAS Name: 2-[[2-(3,4-dimethylanilino)-2-oxoethyl]thio]-6-methyl-1,4-diphenyl-4H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[2-(3,4-dimethylanilino)-2-oxoethyl]sulfanyl-6-methyl-1,4-diphenyl-4H-pyrimidine-5-carboxylate Traditional Name: 2-[[2-(3,4-dimethylanilino)-2-keto-ethyl]thio]-6-methyl-1,4-diphenyl-4H-pyrimidine-5-carboxylic acid ethyl ester Formula: C30H31N3O3S MolecularWeight: 513.65044

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=NC1C2=CC=CC=C2)SCC(=O)NC3=CC(=C(C=C3)C)C)C4=CC=CC=C4)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=NC1C2=CC=CC=C2)SCC(=O)NC3=CC(=C(C=C3)C)C)C4=CC=CC=C4)C

InChI

InChI=1S/C30H31N3O3S/c1-5-36-29(35)27-22(4)33(25-14-10-7-11-15-25)30(32-28(27)23-12-8-6-9-13-23)37-19-26(34)31-24-17-16-20(2)21(3)18-24/h6-18,28H,5,19H2,1-4H3,(H,31,34)