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

Systemtic Name: (5-ethanoyl-2-ethoxy-phenyl)methyl N'-(4-methoxyphenyl)carbamimidothioate Openeye Name: 2-[(5-acetyl-2-ethoxy-phenyl)methyl]-3-(4-methoxyphenyl)isothiourea CAS Name: N'-(4-methoxyphenyl)carbamimidothioic acid (5-acetyl-2-ethoxyphenyl)methyl ester IUPAC Name: (5-acetyl-2-ethoxyphenyl)methyl N'-(4-methoxyphenyl)carbamimidothioate Traditional Name: 2-(5-acetyl-2-ethoxy-benzyl)-3-(4-methoxyphenyl)isothiourea Formula: C19H22N2O3S MolecularWeight: 358.45458

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)C)CSC(=NC2=CC=C(C=C2)OC)N

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)C)CSC(=NC2=CC=C(C=C2)OC)N

InChI

InChI=1S/C19H22N2O3S/c1-4-24-18-10-5-14(13(2)22)11-15(18)12-25-19(20)21-16-6-8-17(23-3)9-7-16/h5-11H,4,12H2,1-3H3,(H2,20,21)