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

Systemtic Name: N-[4-(azepan-1-ylmethyl)-1,3-thiazol-2-yl]-2-chloranyl-5-(diethylsulfamoyl)benzamide Openeye Name: N-[4-(azepan-1-ylmethyl)thiazol-2-yl]-2-chloro-5-(diethylsulfamoyl)benzamide CAS Name: N-[4-(1-azepanylmethyl)-2-thiazolyl]-2-chloro-5-(diethylsulfamoyl)benzamide IUPAC Name: N-[4-(azepan-1-ylmethyl)-1,3-thiazol-2-yl]-2-chloro-5-(diethylsulfamoyl)benzamide Traditional Name: N-[4-(azepan-1-ylmethyl)thiazol-2-yl]-2-chloro-5-(diethylsulfamoyl)benzamide Formula: C21H29ClN4O3S2 MolecularWeight: 485.06296

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H29ClN4O3S2/c1-3-26(4-2)31(28,29)17-9-10-19(22)18(13-17)20(27)24-21-23-16(15-30-21)14-25-11-7-5-6-8-12-25/h9-10,13,15H,3-8,11-12,14H2,1-2H3,(H,23,24,27)