1-[4-(piperidin-1-ylmethyl)phenyl]-3-[2-(trifluoromethyl)phenyl]thiourea

Systemtic Name: 1-[4-(piperidin-1-ylmethyl)phenyl]-3-[2-(trifluoromethyl)phenyl]thiourea Openeye Name: 1-[4-(1-piperidylmethyl)phenyl]-3-[2-(trifluoromethyl)phenyl]thiourea CAS Name: 1-[4-(1-piperidinylmethyl)phenyl]-3-[2-(trifluoromethyl)phenyl]thiourea IUPAC Name: 1-[4-(piperidin-1-ylmethyl)phenyl]-3-[2-(trifluoromethyl)phenyl]thiourea Traditional Name: 1-[4-(piperidinomethyl)phenyl]-3-[2-(trifluoromethyl)phenyl]thiourea Formula: C20H22F3N3S MolecularWeight: 393.46899

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2=CC=C(C=C2)NC(=S)NC3=CC=CC=C3C(F)(F)F

Isomeric SMILES

C1CCN(CC1)CC2=CC=C(C=C2)NC(=S)NC3=CC=CC=C3C(F)(F)F

InChI

InChI=1S/C20H22F3N3S/c21-20(22,23)17-6-2-3-7-18(17)25-19(27)24-16-10-8-15(9-11-16)14-26-12-4-1-5-13-26/h2-3,6-11H,1,4-5,12-14H2,(H2,24,25,27)