ethyl 4-[(4-aminophenyl)sulfonyl-(4-ethoxyphenyl)amino]-6-methyl-2-phenyl-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-[(4-aminophenyl)sulfonyl-(4-ethoxyphenyl)amino]-6-methyl-2-phenyl-pyrimidine-5-carboxylate Openeye Name: ethyl 4-(N-(4-aminophenyl)sulfonyl-4-ethoxy-anilino)-6-methyl-2-phenyl-pyrimidine-5-carboxylate CAS Name: 4-(N-(4-aminophenyl)sulfonyl-4-ethoxyanilino)-6-methyl-2-phenyl-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(N-(4-aminophenyl)sulfonyl-4-ethoxyanilino)-6-methyl-2-phenylpyrimidine-5-carboxylate Traditional Name: 4-(4-ethoxy-N-sulfanilyl-anilino)-6-methyl-2-phenyl-pyrimidine-5-carboxylic acid ethyl ester Formula: C28H28N4O5S MolecularWeight: 532.61072

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N(C2=NC(=NC(=C2C(=O)OCC)C)C3=CC=CC=C3)S(=O)(=O)C4=CC=C(C=C4)N

Isomeric SMILES

CCOC1=CC=C(C=C1)N(C2=NC(=NC(=C2C(=O)OCC)C)C3=CC=CC=C3)S(=O)(=O)C4=CC=C(C=C4)N

InChI

InChI=1S/C28H28N4O5S/c1-4-36-23-15-13-22(14-16-23)32(38(34,35)24-17-11-21(29)12-18-24)27-25(28(33)37-5-2)19(3)30-26(31-27)20-9-7-6-8-10-20/h6-18H,4-5,29H2,1-3H3