2-[(3-ethoxyphenyl)-methylsulfonyl-amino]-N-(3-imidazol-1-ylpropyl)ethanamide

Systemtic Name: 2-[(3-ethoxyphenyl)-methylsulfonyl-amino]-N-(3-imidazol-1-ylpropyl)ethanamide Openeye Name: 2-(3-ethoxy-N-methylsulfonyl-anilino)-N-(3-imidazol-1-ylpropyl)acetamide CAS Name: 2-(3-ethoxy-N-methylsulfonylanilino)-N-[3-(1-imidazolyl)propyl]acetamide IUPAC Name: 2-(3-ethoxy-N-methylsulfonylanilino)-N-(3-imidazol-1-ylpropyl)acetamide Traditional Name: 2-(3-ethoxy-N-mesyl-anilino)-N-(3-imidazol-1-ylpropyl)acetamide Formula: C17H24N4O4S MolecularWeight: 380.46186

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)N(CC(=O)NCCCN2C=CN=C2)S(=O)(=O)C

Isomeric SMILES

CCOC1=CC=CC(=C1)N(CC(=O)NCCCN2C=CN=C2)S(=O)(=O)C

InChI

InChI=1S/C17H24N4O4S/c1-3-25-16-7-4-6-15(12-16)21(26(2,23)24)13-17(22)19-8-5-10-20-11-9-18-14-20/h4,6-7,9,11-12,14H,3,5,8,10,13H2,1-2H3,(H,19,22)