N-(2-chloranyl-6-methyl-phenyl)-3-[[4-(4-methylpiperazin-1-yl)phenyl]carbonylamino]-1H-thieno[3,2-c]pyrazole-5-carboxamide

Systemtic Name: N-(2-chloranyl-6-methyl-phenyl)-3-[[4-(4-methylpiperazin-1-yl)phenyl]carbonylamino]-1H-thieno[3,2-c]pyrazole-5-carboxamide Openeye Name: N-(2-chloro-6-methyl-phenyl)-3-[[4-(4-methylpiperazin-1-yl)benzoyl]amino]-1H-thieno[3,2-c]pyrazole-5-carboxamide CAS Name: N-(2-chloro-6-methylphenyl)-3-[[[4-(4-methyl-1-piperazinyl)phenyl]-oxomethyl]amino]-1H-thieno[3,2-c]pyrazole-5-carboxamide IUPAC Name: N-(2-chloro-6-methylphenyl)-3-[[4-(4-methylpiperazin-1-yl)benzoyl]amino]-1H-thieno[3,2-c]pyrazole-5-carboxamide Traditional Name: N-(2-chloro-6-methyl-phenyl)-3-[[4-(4-methylpiperazino)benzoyl]amino]-1H-thieno[3,2-c]pyrazole-5-carboxamide Formula: C25H25ClN6O2S MolecularWeight: 509.023

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)Cl)NC(=O)C2=CC3=C(S2)C(=NN3)NC(=O)C4=CC=C(C=C4)N5CCN(CC5)C

Isomeric SMILES

CC1=C(C(=CC=C1)Cl)NC(=O)C2=CC3=C(S2)C(=NN3)NC(=O)C4=CC=C(C=C4)N5CCN(CC5)C

InChI

InChI=1S/C25H25ClN6O2S/c1-15-4-3-5-18(26)21(15)27-25(34)20-14-19-22(35-20)23(30-29-19)28-24(33)16-6-8-17(9-7-16)32-12-10-31(2)11-13-32/h3-9,14H,10-13H2,1-2H3,(H,27,34)(H2,28,29,30,33)