N-(2-cyclopropylethyl)-6-[4-[2-(trifluoromethyl)phenyl]carbothioylpiperazin-1-yl]pyridazine-3-carboxamide

Systemtic Name: N-(2-cyclopropylethyl)-6-[4-[2-(trifluoromethyl)phenyl]carbothioylpiperazin-1-yl]pyridazine-3-carboxamide Openeye Name: N-(2-cyclopropylethyl)-6-[4-[2-(trifluoromethyl)benzenecarbothioyl]piperazin-1-yl]pyridazine-3-carboxamide CAS Name: N-(2-cyclopropylethyl)-6-[4-[sulfanylidene-[2-(trifluoromethyl)phenyl]methyl]-1-piperazinyl]-3-pyridazinecarboxamide IUPAC Name: N-(2-cyclopropylethyl)-6-[4-[2-(trifluoromethyl)benzenecarbothioyl]piperazin-1-yl]pyridazine-3-carboxamide Traditional Name: N-(2-cyclopropylethyl)-6-[4-[2-(trifluoromethyl)thiobenzoyl]piperazino]pyridazine-3-carboxamide Formula: C22H24F3N5OS MolecularWeight: 463.51907

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1CCNC(=O)C2=NN=C(C=C2)N3CCN(CC3)C(=S)C4=CC=CC=C4C(F)(F)F

Isomeric SMILES

C1CC1CCNC(=O)C2=NN=C(C=C2)N3CCN(CC3)C(=S)C4=CC=CC=C4C(F)(F)F

InChI

InChI=1S/C22H24F3N5OS/c23-22(24,25)17-4-2-1-3-16(17)21(32)30-13-11-29(12-14-30)19-8-7-18(27-28-19)20(31)26-10-9-15-5-6-15/h1-4,7-8,15H,5-6,9-14H2,(H,26,31)