1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-3-(2-methoxy-4-methyl-phenyl)-1-(phenylmethyl)thiourea

Systemtic Name: 1-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-3-(2-methoxy-4-methyl-phenyl)-1-(phenylmethyl)thiourea Openeye Name: 1-benzyl-1-[(2-chloro-6-fluoro-phenyl)methyl]-3-(2-methoxy-4-methyl-phenyl)thiourea CAS Name: 1-[(2-chloro-6-fluorophenyl)methyl]-3-(2-methoxy-4-methylphenyl)-1-(phenylmethyl)thiourea IUPAC Name: 1-benzyl-1-[(2-chloro-6-fluorophenyl)methyl]-3-(2-methoxy-4-methylphenyl)thiourea Traditional Name: 1-benzyl-1-(2-chloro-6-fluoro-benzyl)-3-(2-methoxy-4-methyl-phenyl)thiourea Formula: C23H22ClFN2OS MolecularWeight: 428.949983

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=S)N(CC2=CC=CC=C2)CC3=C(C=CC=C3Cl)F)OC

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=S)N(CC2=CC=CC=C2)CC3=C(C=CC=C3Cl)F)OC

InChI

InChI=1S/C23H22ClFN2OS/c1-16-11-12-21(22(13-16)28-2)26-23(29)27(14-17-7-4-3-5-8-17)15-18-19(24)9-6-10-20(18)25/h3-13H,14-15H2,1-2H3,(H,26,29)