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

Systemtic Name: 1-[4-(4-propan-2-ylpiperazin-1-yl)sulfonylphenyl]-3-[4-(trifluoromethyl)phenyl]urea Openeye Name: 1-[4-(4-isopropylpiperazin-1-yl)sulfonylphenyl]-3-[4-(trifluoromethyl)phenyl]urea CAS Name: 1-[4-[(4-propan-2-yl-1-piperazinyl)sulfonyl]phenyl]-3-[4-(trifluoromethyl)phenyl]urea IUPAC Name: 1-[4-(4-propan-2-ylpiperazin-1-yl)sulfonylphenyl]-3-[4-(trifluoromethyl)phenyl]urea Traditional Name: 1-[4-(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=C(C=C2)NC(=O)NC3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

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

InChI

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