2-[4-[[3-(propan-2-ylamino)pyrrolidin-1-yl]methyl]phenyl]-1H-benzimidazole-4-carboxamide

Systemtic Name: 2-[4-[[3-(propan-2-ylamino)pyrrolidin-1-yl]methyl]phenyl]-1H-benzimidazole-4-carboxamide Openeye Name: 2-[4-[[3-(isopropylamino)pyrrolidin-1-yl]methyl]phenyl]-1H-benzimidazole-4-carboxamide CAS Name: 2-[4-[[3-(propan-2-ylamino)-1-pyrrolidinyl]methyl]phenyl]-1H-benzimidazole-4-carboxamide IUPAC Name: 2-[4-[[3-(propan-2-ylamino)pyrrolidin-1-yl]methyl]phenyl]-1H-benzimidazole-4-carboxamide Traditional Name: 2-[4-[[3-(isopropylamino)pyrrolidino]methyl]phenyl]-1H-benzimidazole-4-carboxamide Formula: C22H27N5O MolecularWeight: 377.48268

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC1CCN(C1)CC2=CC=C(C=C2)C3=NC4=C(C=CC=C4N3)C(=O)N

Isomeric SMILES

CC(C)NC1CCN(C1)CC2=CC=C(C=C2)C3=NC4=C(C=CC=C4N3)C(=O)N

InChI

InChI=1S/C22H27N5O/c1-14(2)24-17-10-11-27(13-17)12-15-6-8-16(9-7-15)22-25-19-5-3-4-18(21(23)28)20(19)26-22/h3-9,14,17,24H,10-13H2,1-2H3,(H2,23,28)(H,25,26)