2-(3,4-dimethoxyphenyl)sulfanyl-N-(3-imidazol-1-ylpropyl)ethanamide

Systemtic Name: 2-(3,4-dimethoxyphenyl)sulfanyl-N-(3-imidazol-1-ylpropyl)ethanamide Openeye Name: 2-(3,4-dimethoxyphenyl)sulfanyl-N-(3-imidazol-1-ylpropyl)acetamide CAS Name: 2-[(3,4-dimethoxyphenyl)thio]-N-[3-(1-imidazolyl)propyl]acetamide IUPAC Name: 2-(3,4-dimethoxyphenyl)sulfanyl-N-(3-imidazol-1-ylpropyl)acetamide Traditional Name: 2-[(3,4-dimethoxyphenyl)thio]-N-(3-imidazol-1-ylpropyl)acetamide Formula: C16H21N3O3S MolecularWeight: 335.42124

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)SCC(=O)NCCCN2C=CN=C2)OC

Isomeric SMILES

COC1=C(C=C(C=C1)SCC(=O)NCCCN2C=CN=C2)OC

InChI

InChI=1S/C16H21N3O3S/c1-21-14-5-4-13(10-15(14)22-2)23-11-16(20)18-6-3-8-19-9-7-17-12-19/h4-5,7,9-10,12H,3,6,8,11H2,1-2H3,(H,18,20)