1-[3-(4-propan-2-ylpiperazin-1-yl)sulfonylphenyl]-3-[4-(trifluoromethyl)phenyl]urea

Systemtic Name: 1-[3-(4-propan-2-ylpiperazin-1-yl)sulfonylphenyl]-3-[4-(trifluoromethyl)phenyl]urea Openeye Name: 1-[3-(4-isopropylpiperazin-1-yl)sulfonylphenyl]-3-[4-(trifluoromethyl)phenyl]urea CAS Name: 1-[3-[(4-propan-2-yl-1-piperazinyl)sulfonyl]phenyl]-3-[4-(trifluoromethyl)phenyl]urea IUPAC Name: 1-[3-(4-propan-2-ylpiperazin-1-yl)sulfonylphenyl]-3-[4-(trifluoromethyl)phenyl]urea Traditional Name: 1-[3-(4-isopropylpiperazino)sulfonylphenyl]-3-[4-(trifluoromethyl)phenyl]urea Formula: C21H25F3N4O3S MolecularWeight: 470.50841

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)NC3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

CC(C)N1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)NC3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C21H25F3N4O3S/c1-15(2)27-10-12-28(13-11-27)32(30,31)19-5-3-4-18(14-19)26-20(29)25-17-8-6-16(7-9-17)21(22,23)24/h3-9,14-15H,10-13H2,1-2H3,(H2,25,26,29)