(5-ethanoyl-2-methoxy-phenyl)methyl N'-(2,5-dimethylphenyl)carbamimidothioate

Systemtic Name: (5-ethanoyl-2-methoxy-phenyl)methyl N'-(2,5-dimethylphenyl)carbamimidothioate Openeye Name: 2-[(5-acetyl-2-methoxy-phenyl)methyl]-3-(2,5-dimethylphenyl)isothiourea CAS Name: N'-(2,5-dimethylphenyl)carbamimidothioic acid (5-acetyl-2-methoxyphenyl)methyl ester IUPAC Name: (5-acetyl-2-methoxyphenyl)methyl N'-(2,5-dimethylphenyl)carbamimidothioate Traditional Name: 2-(5-acetyl-2-methoxy-benzyl)-3-(2,5-dimethylphenyl)isothiourea Formula: C19H22N2O2S MolecularWeight: 342.45518

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H22N2O2S/c1-12-5-6-13(2)17(9-12)21-19(20)24-11-16-10-15(14(3)22)7-8-18(16)23-4/h5-10H,11H2,1-4H3,(H2,20,21)