N-[5-chloranyl-4-[2-(4-methylphenyl)sulfonylbutanoylamino]-2-oxidanyl-phenyl]-2-methyl-pyrimidine-5-carboxamide

Systemtic Name: N-[5-chloranyl-4-[2-(4-methylphenyl)sulfonylbutanoylamino]-2-oxidanyl-phenyl]-2-methyl-pyrimidine-5-carboxamide Openeye Name: N-[5-chloro-2-hydroxy-4-[2-(p-tolylsulfonyl)butanoylamino]phenyl]-2-methyl-pyrimidine-5-carboxamide CAS Name: N-[5-chloro-2-hydroxy-4-[[2-(4-methylphenyl)sulfonyl-1-oxobutyl]amino]phenyl]-2-methyl-5-pyrimidinecarboxamide IUPAC Name: N-[5-chloro-2-hydroxy-4-[2-(4-methylphenyl)sulfonylbutanoylamino]phenyl]-2-methylpyrimidine-5-carboxamide Traditional Name: N-[5-chloro-2-hydroxy-4-(2-tosylbutanoylamino)phenyl]-2-methyl-pyrimidine-5-carboxamide Formula: C23H23ClN4O5S MolecularWeight: 502.97052

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC(=C(C=C1Cl)NC(=O)C2=CN=C(N=C2)C)O)S(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CCC(C(=O)NC1=CC(=C(C=C1Cl)NC(=O)C2=CN=C(N=C2)C)O)S(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C23H23ClN4O5S/c1-4-21(34(32,33)16-7-5-13(2)6-8-16)23(31)27-18-10-20(29)19(9-17(18)24)28-22(30)15-11-25-14(3)26-12-15/h5-12,21,29H,4H2,1-3H3,(H,27,31)(H,28,30)