(5-ethanoyl-2-ethoxy-phenyl)methyl N'-(4-ethoxyphenyl)carbamimidothioate

Systemtic Name: (5-ethanoyl-2-ethoxy-phenyl)methyl N'-(4-ethoxyphenyl)carbamimidothioate Openeye Name: 2-[(5-acetyl-2-ethoxy-phenyl)methyl]-3-(4-ethoxyphenyl)isothiourea CAS Name: N'-(4-ethoxyphenyl)carbamimidothioic acid (5-acetyl-2-ethoxyphenyl)methyl ester IUPAC Name: (5-acetyl-2-ethoxyphenyl)methyl N'-(4-ethoxyphenyl)carbamimidothioate Traditional Name: 2-(5-acetyl-2-ethoxy-benzyl)-3-p-phenetyl-isothiourea Formula: C20H24N2O3S MolecularWeight: 372.48116

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N=C(N)SCC2=C(C=CC(=C2)C(=O)C)OCC

Isomeric SMILES

CCOC1=CC=C(C=C1)N=C(N)SCC2=C(C=CC(=C2)C(=O)C)OCC

InChI

InChI=1S/C20H24N2O3S/c1-4-24-18-9-7-17(8-10-18)22-20(21)26-13-16-12-15(14(3)23)6-11-19(16)25-5-2/h6-12H,4-5,13H2,1-3H3,(H2,21,22)