1-[[1-(2-methylcyclohexyl)pyrrolidin-3-yl]methyl]-3-[3-(trifluoromethyl)phenyl]thiourea

Systemtic Name: 1-[[1-(2-methylcyclohexyl)pyrrolidin-3-yl]methyl]-3-[3-(trifluoromethyl)phenyl]thiourea Openeye Name: 1-[[1-(2-methylcyclohexyl)pyrrolidin-3-yl]methyl]-3-[3-(trifluoromethyl)phenyl]thiourea CAS Name: 1-[[1-(2-methylcyclohexyl)-3-pyrrolidinyl]methyl]-3-[3-(trifluoromethyl)phenyl]thiourea IUPAC Name: 1-[[1-(2-methylcyclohexyl)pyrrolidin-3-yl]methyl]-3-[3-(trifluoromethyl)phenyl]thiourea Traditional Name: 1-[[1-(2-methylcyclohexyl)pyrrolidin-3-yl]methyl]-3-[3-(trifluoromethyl)phenyl]thiourea Formula: C20H28F3N3S MolecularWeight: 399.51663

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1N2CCC(C2)CNC(=S)NC3=CC=CC(=C3)C(F)(F)F

Isomeric SMILES

CC1CCCCC1N2CCC(C2)CNC(=S)NC3=CC=CC(=C3)C(F)(F)F

InChI

InChI=1S/C20H28F3N3S/c1-14-5-2-3-8-18(14)26-10-9-15(13-26)12-24-19(27)25-17-7-4-6-16(11-17)20(21,22)23/h4,6-7,11,14-15,18H,2-3,5,8-10,12-13H2,1H3,(H2,24,25,27)