N-[3-(benzimidazol-1-yl)propyl]-1-(5-bromanylthiophen-2-yl)sulfonyl-pyrrolidine-2-carboxamide

Systemtic Name: N-[3-(benzimidazol-1-yl)propyl]-1-(5-bromanylthiophen-2-yl)sulfonyl-pyrrolidine-2-carboxamide Openeye Name: N-[3-(benzimidazol-1-yl)propyl]-1-[(5-bromo-2-thienyl)sulfonyl]pyrrolidine-2-carboxamide CAS Name: N-[3-(1-benzimidazolyl)propyl]-1-[(5-bromo-2-thiophenyl)sulfonyl]-2-pyrrolidinecarboxamide IUPAC Name: N-[3-(benzimidazol-1-yl)propyl]-1-(5-bromothiophen-2-yl)sulfonylpyrrolidine-2-carboxamide Traditional Name: N-[3-(benzimidazol-1-yl)propyl]-1-[(5-bromo-2-thienyl)sulfonyl]pyrrolidine-2-carboxamide Formula: C19H21BrN4O3S2 MolecularWeight: 497.42904

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)S(=O)(=O)C2=CC=C(S2)Br)C(=O)NCCCN3C=NC4=CC=CC=C43

Isomeric SMILES

C1CC(N(C1)S(=O)(=O)C2=CC=C(S2)Br)C(=O)NCCCN3C=NC4=CC=CC=C43

InChI

InChI=1S/C19H21BrN4O3S2/c20-17-8-9-18(28-17)29(26,27)24-12-3-7-16(24)19(25)21-10-4-11-23-13-22-14-5-1-2-6-15(14)23/h1-2,5-6,8-9,13,16H,3-4,7,10-12H2,(H,21,25)