N-(6-chloranyl-1,3-benzothiazol-2-yl)-4-(diethylsulfamoyl)-1-methyl-pyrrole-2-carboxamide

Systemtic Name: N-(6-chloranyl-1,3-benzothiazol-2-yl)-4-(diethylsulfamoyl)-1-methyl-pyrrole-2-carboxamide Openeye Name: N-(6-chloro-1,3-benzothiazol-2-yl)-4-(diethylsulfamoyl)-1-methyl-pyrrole-2-carboxamide CAS Name: N-(6-chloro-1,3-benzothiazol-2-yl)-4-(diethylsulfamoyl)-1-methyl-2-pyrrolecarboxamide IUPAC Name: N-(6-chloro-1,3-benzothiazol-2-yl)-4-(diethylsulfamoyl)-1-methylpyrrole-2-carboxamide Traditional Name: N-(6-chloro-1,3-benzothiazol-2-yl)-4-(diethylsulfamoyl)-1-methyl-pyrrole-2-carboxamide Formula: C17H19ClN4O3S2 MolecularWeight: 426.94076

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CN(C(=C1)C(=O)NC2=NC3=C(S2)C=C(C=C3)Cl)C

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CN(C(=C1)C(=O)NC2=NC3=C(S2)C=C(C=C3)Cl)C

InChI

InChI=1S/C17H19ClN4O3S2/c1-4-22(5-2)27(24,25)12-9-14(21(3)10-12)16(23)20-17-19-13-7-6-11(18)8-15(13)26-17/h6-10H,4-5H2,1-3H3,(H,19,20,23)