N-[4-(azepan-1-ylmethyl)-1,3-thiazol-2-yl]-5-(diethylsulfamoyl)-2-methyl-benzamide

Systemtic Name: N-[4-(azepan-1-ylmethyl)-1,3-thiazol-2-yl]-5-(diethylsulfamoyl)-2-methyl-benzamide Openeye Name: N-[4-(azepan-1-ylmethyl)thiazol-2-yl]-5-(diethylsulfamoyl)-2-methyl-benzamide CAS Name: N-[4-(1-azepanylmethyl)-2-thiazolyl]-5-(diethylsulfamoyl)-2-methylbenzamide IUPAC Name: N-[4-(azepan-1-ylmethyl)-1,3-thiazol-2-yl]-5-(diethylsulfamoyl)-2-methylbenzamide Traditional Name: N-[4-(azepan-1-ylmethyl)thiazol-2-yl]-5-(diethylsulfamoyl)-2-methyl-benzamide Formula: C22H32N4O3S2 MolecularWeight: 464.64448

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)C)C(=O)NC2=NC(=CS2)CN3CCCCCC3

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)C)C(=O)NC2=NC(=CS2)CN3CCCCCC3

InChI

InChI=1S/C22H32N4O3S2/c1-4-26(5-2)31(28,29)19-11-10-17(3)20(14-19)21(27)24-22-23-18(16-30-22)15-25-12-8-6-7-9-13-25/h10-11,14,16H,4-9,12-13,15H2,1-3H3,(H,23,24,27)