1-[(3-chloranyl-4-fluoranyl-phenyl)methyl]-3-(3-cyanophenyl)thiourea

Systemtic Name: 1-[(3-chloranyl-4-fluoranyl-phenyl)methyl]-3-(3-cyanophenyl)thiourea Openeye Name: 1-[(3-chloro-4-fluoro-phenyl)methyl]-3-(3-cyanophenyl)thiourea CAS Name: 1-[(3-chloro-4-fluorophenyl)methyl]-3-(3-cyanophenyl)thiourea IUPAC Name: 1-[(3-chloro-4-fluorophenyl)methyl]-3-(3-cyanophenyl)thiourea Traditional Name: 1-(3-chloro-4-fluoro-benzyl)-3-(3-cyanophenyl)thiourea Formula: C15H11ClFN3S MolecularWeight: 319.784343

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=S)NCC2=CC(=C(C=C2)F)Cl)C#N

Isomeric SMILES

C1=CC(=CC(=C1)NC(=S)NCC2=CC(=C(C=C2)F)Cl)C#N

InChI

InChI=1S/C15H11ClFN3S/c16-13-7-11(4-5-14(13)17)9-19-15(21)20-12-3-1-2-10(6-12)8-18/h1-7H,9H2,(H2,19,20,21)