5-[(4-chloranyl-3-morpholin-4-ylsulfonyl-phenyl)carbonylcarbamothioylamino]-1-(2,4-dimethylphenyl)pyrazole-4-carboxamide

Systemtic Name: 5-[(4-chloranyl-3-morpholin-4-ylsulfonyl-phenyl)carbonylcarbamothioylamino]-1-(2,4-dimethylphenyl)pyrazole-4-carboxamide Openeye Name: 5-[(4-chloro-3-morpholinosulfonyl-benzoyl)carbamothioylamino]-1-(2,4-dimethylphenyl)pyrazole-4-carboxamide CAS Name: 5-[[[[[4-chloro-3-(4-morpholinylsulfonyl)phenyl]-oxomethyl]amino]-sulfanylidenemethyl]amino]-1-(2,4-dimethylphenyl)-4-pyrazolecarboxamide IUPAC Name: 5-[(4-chloro-3-morpholin-4-ylsulfonylbenzoyl)carbamothioylamino]-1-(2,4-dimethylphenyl)pyrazole-4-carboxamide Traditional Name: 5-[(4-chloro-3-morpholinosulfonyl-benzoyl)thiocarbamoylamino]-1-(2,4-dimethylphenyl)pyrazole-4-carboxamide Formula: C24H25ClN6O5S2 MolecularWeight: 577.0755

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N2C(=C(C=N2)C(=O)N)NC(=S)NC(=O)C3=CC(=C(C=C3)Cl)S(=O)(=O)N4CCOCC4)C

Isomeric SMILES

CC1=CC(=C(C=C1)N2C(=C(C=N2)C(=O)N)NC(=S)NC(=O)C3=CC(=C(C=C3)Cl)S(=O)(=O)N4CCOCC4)C

InChI

InChI=1S/C24H25ClN6O5S2/c1-14-3-6-19(15(2)11-14)31-22(17(13-27-31)21(26)32)28-24(37)29-23(33)16-4-5-18(25)20(12-16)38(34,35)30-7-9-36-10-8-30/h3-6,11-13H,7-10H2,1-2H3,(H2,26,32)(H2,28,29,33,37)