3-[3-chloranyl-4-(trifluoromethyl)phenyl]-1-cyclopropyl-1-(pyridin-3-ylmethyl)thiourea

Systemtic Name: 3-[3-chloranyl-4-(trifluoromethyl)phenyl]-1-cyclopropyl-1-(pyridin-3-ylmethyl)thiourea Openeye Name: 3-[3-chloro-4-(trifluoromethyl)phenyl]-1-cyclopropyl-1-(3-pyridylmethyl)thiourea CAS Name: 3-[3-chloro-4-(trifluoromethyl)phenyl]-1-cyclopropyl-1-(3-pyridinylmethyl)thiourea IUPAC Name: 3-[3-chloro-4-(trifluoromethyl)phenyl]-1-cyclopropyl-1-(pyridin-3-ylmethyl)thiourea Traditional Name: 3-[3-chloro-4-(trifluoromethyl)phenyl]-1-cyclopropyl-1-(3-pyridylmethyl)thiourea Formula: C17H15ClF3N3S MolecularWeight: 385.83431

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N(CC2=CN=CC=C2)C(=S)NC3=CC(=C(C=C3)C(F)(F)F)Cl

Isomeric SMILES

C1CC1N(CC2=CN=CC=C2)C(=S)NC3=CC(=C(C=C3)C(F)(F)F)Cl

InChI

InChI=1S/C17H15ClF3N3S/c18-15-8-12(3-6-14(15)17(19,20)21)23-16(25)24(13-4-5-13)10-11-2-1-7-22-9-11/h1-3,6-9,13H,4-5,10H2,(H,23,25)