4-[[2-chloranyl-5-(4-ethylpiperazin-1-yl)sulfonyl-phenyl]carbonylamino]-5-ethyl-1-(pyridin-2-ylmethyl)pyrazole-3-carboxamide

Systemtic Name: 4-[[2-chloranyl-5-(4-ethylpiperazin-1-yl)sulfonyl-phenyl]carbonylamino]-5-ethyl-1-(pyridin-2-ylmethyl)pyrazole-3-carboxamide Openeye Name: 4-[[2-chloro-5-(4-ethylpiperazin-1-yl)sulfonyl-benzoyl]amino]-5-ethyl-1-(2-pyridylmethyl)pyrazole-3-carboxamide CAS Name: 4-[[[2-chloro-5-[(4-ethyl-1-piperazinyl)sulfonyl]phenyl]-oxomethyl]amino]-5-ethyl-1-(2-pyridinylmethyl)-3-pyrazolecarboxamide IUPAC Name: 4-[[2-chloro-5-(4-ethylpiperazin-1-yl)sulfonylbenzoyl]amino]-5-ethyl-1-(pyridin-2-ylmethyl)pyrazole-3-carboxamide Traditional Name: 4-[[2-chloro-5-(4-ethylpiperazino)sulfonyl-benzoyl]amino]-5-ethyl-1-(2-pyridylmethyl)pyrazole-3-carboxamide Formula: C25H30ClN7O4S MolecularWeight: 560.0682

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NN1CC2=CC=CC=N2)C(=O)N)NC(=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCN(CC4)CC)Cl

Isomeric SMILES

CCC1=C(C(=NN1CC2=CC=CC=N2)C(=O)N)NC(=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCN(CC4)CC)Cl

InChI

InChI=1S/C25H30ClN7O4S/c1-3-21-22(23(24(27)34)30-33(21)16-17-7-5-6-10-28-17)29-25(35)19-15-18(8-9-20(19)26)38(36,37)32-13-11-31(4-2)12-14-32/h5-10,15H,3-4,11-14,16H2,1-2H3,(H2,27,34)(H,29,35)