4-[3-(benzimidazol-1-yl)propylamino]-3-nitro-N-propan-2-yl-benzenesulfonamide

Systemtic Name: 4-[3-(benzimidazol-1-yl)propylamino]-3-nitro-N-propan-2-yl-benzenesulfonamide Openeye Name: 4-[3-(benzimidazol-1-yl)propylamino]-N-isopropyl-3-nitro-benzenesulfonamide CAS Name: 4-[3-(1-benzimidazolyl)propylamino]-3-nitro-N-propan-2-ylbenzenesulfonamide IUPAC Name: 4-[3-(benzimidazol-1-yl)propylamino]-3-nitro-N-propan-2-ylbenzenesulfonamide Traditional Name: 4-[3-(benzimidazol-1-yl)propylamino]-N-isopropyl-3-nitro-benzenesulfonamide Formula: C19H23N5O4S MolecularWeight: 417.48202

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NS(=O)(=O)C1=CC(=C(C=C1)NCCCN2C=NC3=CC=CC=C32)[N+](=O)[O-]

Isomeric SMILES

CC(C)NS(=O)(=O)C1=CC(=C(C=C1)NCCCN2C=NC3=CC=CC=C32)[N+](=O)[O-]

InChI

InChI=1S/C19H23N5O4S/c1-14(2)22-29(27,28)15-8-9-17(19(12-15)24(25)26)20-10-5-11-23-13-21-16-6-3-4-7-18(16)23/h3-4,6-9,12-14,20,22H,5,10-11H2,1-2H3