(3-fluoranyl-4-methoxy-phenyl)methyl N'-(3,4-dimethylphenyl)carbamimidothioate

Systemtic Name: (3-fluoranyl-4-methoxy-phenyl)methyl N'-(3,4-dimethylphenyl)carbamimidothioate Openeye Name: 3-(3,4-dimethylphenyl)-2-[(3-fluoro-4-methoxy-phenyl)methyl]isothiourea CAS Name: N'-(3,4-dimethylphenyl)carbamimidothioic acid (3-fluoro-4-methoxyphenyl)methyl ester IUPAC Name: (3-fluoro-4-methoxyphenyl)methyl N'-(3,4-dimethylphenyl)carbamimidothioate Traditional Name: 3-(3,4-dimethylphenyl)-2-(3-fluoro-4-methoxy-benzyl)isothiourea Formula: C17H19FN2OS MolecularWeight: 318.408963

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N=C(N)SCC2=CC(=C(C=C2)OC)F)C

Isomeric SMILES

CC1=C(C=C(C=C1)N=C(N)SCC2=CC(=C(C=C2)OC)F)C

InChI

InChI=1S/C17H19FN2OS/c1-11-4-6-14(8-12(11)2)20-17(19)22-10-13-5-7-16(21-3)15(18)9-13/h4-9H,10H2,1-3H3,(H2,19,20)