3-[2-chloranyl-4-(trifluoromethyl)phenyl]-1-cyclopentyl-1-(thiophen-2-ylmethyl)thiourea

Systemtic Name: 3-[2-chloranyl-4-(trifluoromethyl)phenyl]-1-cyclopentyl-1-(thiophen-2-ylmethyl)thiourea Openeye Name: 3-[2-chloro-4-(trifluoromethyl)phenyl]-1-cyclopentyl-1-(2-thienylmethyl)thiourea CAS Name: 3-[2-chloro-4-(trifluoromethyl)phenyl]-1-cyclopentyl-1-(thiophen-2-ylmethyl)thiourea IUPAC Name: 3-[2-chloro-4-(trifluoromethyl)phenyl]-1-cyclopentyl-1-(thiophen-2-ylmethyl)thiourea Traditional Name: 3-[2-chloro-4-(trifluoromethyl)phenyl]-1-cyclopentyl-1-(2-thenyl)thiourea Formula: C18H18ClF3N2S2 MolecularWeight: 418.92713

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N(CC2=CC=CS2)C(=S)NC3=C(C=C(C=C3)C(F)(F)F)Cl

Isomeric SMILES

C1CCC(C1)N(CC2=CC=CS2)C(=S)NC3=C(C=C(C=C3)C(F)(F)F)Cl

InChI

InChI=1S/C18H18ClF3N2S2/c19-15-10-12(18(20,21)22)7-8-16(15)23-17(25)24(13-4-1-2-5-13)11-14-6-3-9-26-14/h3,6-10,13H,1-2,4-5,11H2,(H,23,25)