3-cyclopentyl-2-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]-N-[6-(trifluoromethyloxy)-1,3-benzothiazol-2-yl]propanamide

Systemtic Name: 3-cyclopentyl-2-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]-N-[6-(trifluoromethyloxy)-1,3-benzothiazol-2-yl]propanamide Openeye Name: 3-cyclopentyl-2-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]-N-[6-(trifluoromethoxy)-1,3-benzothiazol-2-yl]propanamide CAS Name: 3-cyclopentyl-2-[4-[(4-methyl-1-piperazinyl)sulfonyl]phenyl]-N-[6-(trifluoromethoxy)-1,3-benzothiazol-2-yl]propanamide IUPAC Name: 3-cyclopentyl-2-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]-N-[6-(trifluoromethoxy)-1,3-benzothiazol-2-yl]propanamide Traditional Name: 3-cyclopentyl-2-[4-(4-methylpiperazino)sulfonylphenyl]-N-[6-(trifluoromethoxy)-1,3-benzothiazol-2-yl]propionamide Formula: C27H31F3N4O4S2 MolecularWeight: 596.68465

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(CC3CCCC3)C(=O)NC4=NC5=C(S4)C=C(C=C5)OC(F)(F)F

Isomeric SMILES

CN1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C(CC3CCCC3)C(=O)NC4=NC5=C(S4)C=C(C=C5)OC(F)(F)F

InChI

InChI=1S/C27H31F3N4O4S2/c1-33-12-14-34(15-13-33)40(36,37)21-9-6-19(7-10-21)22(16-18-4-2-3-5-18)25(35)32-26-31-23-11-8-20(17-24(23)39-26)38-27(28,29)30/h6-11,17-18,22H,2-5,12-16H2,1H3,(H,31,32,35)