methyl 4-[2-[(4-chloranyl-2-methyl-phenyl)amino]-5-methyl-pyrimidin-4-yl]-1-(4-methylphenyl)sulfonyl-pyrrole-2-carboxylate

Systemtic Name: methyl 4-[2-[(4-chloranyl-2-methyl-phenyl)amino]-5-methyl-pyrimidin-4-yl]-1-(4-methylphenyl)sulfonyl-pyrrole-2-carboxylate Openeye Name: methyl 4-[2-(4-chloro-2-methyl-anilino)-5-methyl-pyrimidin-4-yl]-1-(p-tolylsulfonyl)pyrrole-2-carboxylate CAS Name: 4-[2-(4-chloro-2-methylanilino)-5-methyl-4-pyrimidinyl]-1-(4-methylphenyl)sulfonyl-2-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl 4-[2-(4-chloro-2-methylanilino)-5-methylpyrimidin-4-yl]-1-(4-methylphenyl)sulfonylpyrrole-2-carboxylate Traditional Name: 4-[2-(4-chloro-2-methyl-anilino)-5-methyl-pyrimidin-4-yl]-1-tosyl-pyrrole-2-carboxylic acid methyl ester Formula: C25H23ClN4O4S MolecularWeight: 510.99252

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C=C(C=C2C(=O)OC)C3=NC(=NC=C3C)NC4=C(C=C(C=C4)Cl)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C=C(C=C2C(=O)OC)C3=NC(=NC=C3C)NC4=C(C=C(C=C4)Cl)C

InChI

InChI=1S/C25H23ClN4O4S/c1-15-5-8-20(9-6-15)35(32,33)30-14-18(12-22(30)24(31)34-4)23-17(3)13-27-25(29-23)28-21-10-7-19(26)11-16(21)2/h5-14H,1-4H3,(H,27,28,29)