1-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]-3-[2-(trifluoromethyl)phenyl]thiourea

Systemtic Name: 1-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]-3-[2-(trifluoromethyl)phenyl]thiourea Openeye Name: 1-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]-3-[2-(trifluoromethyl)phenyl]thiourea CAS Name: 1-[4-[(4-methyl-1-piperazinyl)sulfonyl]phenyl]-3-[2-(trifluoromethyl)phenyl]thiourea IUPAC Name: 1-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]-3-[2-(trifluoromethyl)phenyl]thiourea Traditional Name: 1-[4-(4-methylpiperazino)sulfonylphenyl]-3-[2-(trifluoromethyl)phenyl]thiourea Formula: C19H21F3N4O2S2 MolecularWeight: 458.52085

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=S)NC3=CC=CC=C3C(F)(F)F

Isomeric SMILES

CN1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=S)NC3=CC=CC=C3C(F)(F)F

InChI

InChI=1S/C19H21F3N4O2S2/c1-25-10-12-26(13-11-25)30(27,28)15-8-6-14(7-9-15)23-18(29)24-17-5-3-2-4-16(17)19(20,21)22/h2-9H,10-13H2,1H3,(H2,23,24,29)