2-[(3-chloranyl-4-ethoxy-phenyl)sulfonyl-methyl-amino]-N-(3-imidazol-1-ylpropyl)ethanamide

Systemtic Name: 2-[(3-chloranyl-4-ethoxy-phenyl)sulfonyl-methyl-amino]-N-(3-imidazol-1-ylpropyl)ethanamide Openeye Name: 2-[(3-chloro-4-ethoxy-phenyl)sulfonyl-methyl-amino]-N-(3-imidazol-1-ylpropyl)acetamide CAS Name: 2-[(3-chloro-4-ethoxyphenyl)sulfonyl-methylamino]-N-[3-(1-imidazolyl)propyl]acetamide IUPAC Name: 2-[(3-chloro-4-ethoxyphenyl)sulfonyl-methylamino]-N-(3-imidazol-1-ylpropyl)acetamide Traditional Name: 2-[(3-chloro-4-ethoxy-phenyl)sulfonyl-methyl-amino]-N-(3-imidazol-1-ylpropyl)acetamide Formula: C17H23ClN4O4S MolecularWeight: 414.90692

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H23ClN4O4S/c1-3-26-16-6-5-14(11-15(16)18)27(24,25)21(2)12-17(23)20-7-4-9-22-10-8-19-13-22/h5-6,8,10-11,13H,3-4,7,9,12H2,1-2H3,(H,20,23)