1-[3,5-bis(trifluoromethyl)phenyl]-3-[[(2R)-1-ethylpyrrolidin-2-yl]methyl]thiourea

Systemtic Name: 1-[3,5-bis(trifluoromethyl)phenyl]-3-[[(2R)-1-ethylpyrrolidin-2-yl]methyl]thiourea Openeye Name: 1-[3,5-bis(trifluoromethyl)phenyl]-3-[[(2R)-1-ethylpyrrolidin-2-yl]methyl]thiourea CAS Name: 1-[3,5-bis(trifluoromethyl)phenyl]-3-[[(2R)-1-ethyl-2-pyrrolidinyl]methyl]thiourea IUPAC Name: 1-[3,5-bis(trifluoromethyl)phenyl]-3-[[(2R)-1-ethylpyrrolidin-2-yl]methyl]thiourea Traditional Name: 1-[3,5-bis(trifluoromethyl)phenyl]-3-[[(2R)-1-ethylpyrrolidin-2-yl]methyl]thiourea Formula: C16H19F6N3S MolecularWeight: 399.397579

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCCC1CNC(=S)NC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F

Isomeric SMILES

CCN1CCC[C@@H]1CNC(=S)NC2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C16H19F6N3S/c1-2-25-5-3-4-13(25)9-23-14(26)24-12-7-10(15(17,18)19)6-11(8-12)16(20,21)22/h6-8,13H,2-5,9H2,1H3,(H2,23,24,26)/t13-/m1/s1