N-[3-(benzimidazol-1-yl)propyl]-2-chloranyl-5-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[3-(benzimidazol-1-yl)propyl]-2-chloranyl-5-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-[3-(benzimidazol-1-yl)propyl]-2-chloro-5-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-[3-(1-benzimidazolyl)propyl]-2-chloro-5-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-[3-(benzimidazol-1-yl)propyl]-2-chloro-5-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-[3-(benzimidazol-1-yl)propyl]-2-chloro-5-pyrrolidinosulfonyl-benzamide Formula: C21H23ClN4O3S MolecularWeight: 446.95032

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NCCCN3C=NC4=CC=CC=C43

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NCCCN3C=NC4=CC=CC=C43

InChI

InChI=1S/C21H23ClN4O3S/c22-18-9-8-16(30(28,29)26-12-3-4-13-26)14-17(18)21(27)23-10-5-11-25-15-24-19-6-1-2-7-20(19)25/h1-2,6-9,14-15H,3-5,10-13H2,(H,23,27)