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

Systemtic Name: (5-ethanoyl-2-ethoxy-phenyl)methyl N'-(2-methoxyethyl)carbamimidothioate Openeye Name: 2-[(5-acetyl-2-ethoxy-phenyl)methyl]-3-(2-methoxyethyl)isothiourea CAS Name: N'-(2-methoxyethyl)carbamimidothioic acid (5-acetyl-2-ethoxyphenyl)methyl ester IUPAC Name: (5-acetyl-2-ethoxyphenyl)methyl N'-(2-methoxyethyl)carbamimidothioate Traditional Name: 2-(5-acetyl-2-ethoxy-benzyl)-3-(2-methoxyethyl)isothiourea Formula: C15H22N2O3S MolecularWeight: 310.41178

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)C)CSC(=NCCOC)N

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)C)CSC(=NCCOC)N

InChI

InChI=1S/C15H22N2O3S/c1-4-20-14-6-5-12(11(2)18)9-13(14)10-21-15(16)17-7-8-19-3/h5-6,9H,4,7-8,10H2,1-3H3,(H2,16,17)