1-[4-(2-azanylethyl)phenyl]-N-tert-butyl-6-chloranyl-2-ethyl-benzimidazole-5-sulfonamide

Systemtic Name: 1-[4-(2-azanylethyl)phenyl]-N-tert-butyl-6-chloranyl-2-ethyl-benzimidazole-5-sulfonamide Openeye Name: 1-[4-(2-aminoethyl)phenyl]-N-tert-butyl-6-chloro-2-ethyl-benzimidazole-5-sulfonamide CAS Name: 1-[4-(2-aminoethyl)phenyl]-N-tert-butyl-6-chloro-2-ethyl-5-benzimidazolesulfonamide IUPAC Name: 1-[4-(2-aminoethyl)phenyl]-N-tert-butyl-6-chloro-2-ethylbenzimidazole-5-sulfonamide Traditional Name: 1-[4-(2-aminoethyl)phenyl]-N-tert-butyl-6-chloro-2-ethyl-benzimidazole-5-sulfonamide Formula: C21H27ClN4O2S MolecularWeight: 434.98268

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=CC(=C(C=C2N1C3=CC=C(C=C3)CCN)Cl)S(=O)(=O)NC(C)(C)C

Isomeric SMILES

CCC1=NC2=CC(=C(C=C2N1C3=CC=C(C=C3)CCN)Cl)S(=O)(=O)NC(C)(C)C

InChI

InChI=1S/C21H27ClN4O2S/c1-5-20-24-17-13-19(29(27,28)25-21(2,3)4)16(22)12-18(17)26(20)15-8-6-14(7-9-15)10-11-23/h6-9,12-13,25H,5,10-11,23H2,1-4H3