3-(3-chloranyl-4-fluoranyl-phenyl)-1-cyclopropyl-1-(pyridin-4-ylmethyl)thiourea

Systemtic Name: 3-(3-chloranyl-4-fluoranyl-phenyl)-1-cyclopropyl-1-(pyridin-4-ylmethyl)thiourea Openeye Name: 3-(3-chloro-4-fluoro-phenyl)-1-cyclopropyl-1-(4-pyridylmethyl)thiourea CAS Name: 3-(3-chloro-4-fluorophenyl)-1-cyclopropyl-1-(pyridin-4-ylmethyl)thiourea IUPAC Name: 3-(3-chloro-4-fluorophenyl)-1-cyclopropyl-1-(pyridin-4-ylmethyl)thiourea Traditional Name: 3-(3-chloro-4-fluoro-phenyl)-1-cyclopropyl-1-(4-pyridylmethyl)thiourea Formula: C16H15ClFN3S MolecularWeight: 335.826803

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15ClFN3S/c17-14-9-12(1-4-15(14)18)20-16(22)21(13-2-3-13)10-11-5-7-19-8-6-11/h1,4-9,13H,2-3,10H2,(H,20,22)