N-(3-nitrophenyl)-3-(1-propyl-5-pyrrolidin-1-ylsulfonyl-benzimidazol-2-yl)propanamide

Systemtic Name: N-(3-nitrophenyl)-3-(1-propyl-5-pyrrolidin-1-ylsulfonyl-benzimidazol-2-yl)propanamide Openeye Name: N-(3-nitrophenyl)-3-(1-propyl-5-pyrrolidin-1-ylsulfonyl-benzimidazol-2-yl)propanamide CAS Name: N-(3-nitrophenyl)-3-[1-propyl-5-(1-pyrrolidinylsulfonyl)-2-benzimidazolyl]propanamide IUPAC Name: N-(3-nitrophenyl)-3-(1-propyl-5-pyrrolidin-1-ylsulfonylbenzimidazol-2-yl)propanamide Traditional Name: N-(3-nitrophenyl)-3-(1-propyl-5-pyrrolidinosulfonyl-benzimidazol-2-yl)propionamide Formula: C23H27N5O5S MolecularWeight: 485.55598

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)N=C1CCC(=O)NC4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)N=C1CCC(=O)NC4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H27N5O5S/c1-2-12-27-21-9-8-19(34(32,33)26-13-3-4-14-26)16-20(21)25-22(27)10-11-23(29)24-17-6-5-7-18(15-17)28(30)31/h5-9,15-16H,2-4,10-14H2,1H3,(H,24,29)