1-[(3-chloranyl-4-fluoranyl-phenyl)methyl]-3-(2,4,5-trimethylphenyl)thiourea

Systemtic Name: 1-[(3-chloranyl-4-fluoranyl-phenyl)methyl]-3-(2,4,5-trimethylphenyl)thiourea Openeye Name: 1-[(3-chloro-4-fluoro-phenyl)methyl]-3-(2,4,5-trimethylphenyl)thiourea CAS Name: 1-[(3-chloro-4-fluorophenyl)methyl]-3-(2,4,5-trimethylphenyl)thiourea IUPAC Name: 1-[(3-chloro-4-fluorophenyl)methyl]-3-(2,4,5-trimethylphenyl)thiourea Traditional Name: 1-(3-chloro-4-fluoro-benzyl)-3-(2,4,5-trimethylphenyl)thiourea Formula: C17H18ClFN2S MolecularWeight: 336.854623

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C)NC(=S)NCC2=CC(=C(C=C2)F)Cl)C

Isomeric SMILES

CC1=CC(=C(C=C1C)NC(=S)NCC2=CC(=C(C=C2)F)Cl)C

InChI

InChI=1S/C17H18ClFN2S/c1-10-6-12(3)16(7-11(10)2)21-17(22)20-9-13-4-5-15(19)14(18)8-13/h4-8H,9H2,1-3H3,(H2,20,21,22)