1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-3-(3,4-dimethylphenyl)-1-methyl-thiourea

Systemtic Name: 1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-3-(3,4-dimethylphenyl)-1-methyl-thiourea Openeye Name: 1-[(2-chloro-6-fluoro-phenyl)methyl]-3-(3,4-dimethylphenyl)-1-methyl-thiourea CAS Name: 1-[(2-chloro-6-fluorophenyl)methyl]-3-(3,4-dimethylphenyl)-1-methylthiourea IUPAC Name: 1-[(2-chloro-6-fluorophenyl)methyl]-3-(3,4-dimethylphenyl)-1-methylthiourea Traditional Name: 1-(2-chloro-6-fluoro-benzyl)-3-(3,4-dimethylphenyl)-1-methyl-thiourea Formula: C17H18ClFN2S MolecularWeight: 336.854623

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=S)N(C)CC2=C(C=CC=C2Cl)F)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=S)N(C)CC2=C(C=CC=C2Cl)F)C

InChI

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