N-[3-chloranyl-2-(phenylmethyl)piperazin-1-yl]-N-propan-2-yl-3H-benzimidazole-5-carboxamide

Systemtic Name: N-[3-chloranyl-2-(phenylmethyl)piperazin-1-yl]-N-propan-2-yl-3H-benzimidazole-5-carboxamide Openeye Name: N-(2-benzyl-3-chloro-piperazin-1-yl)-N-isopropyl-3H-benzimidazole-5-carboxamide CAS Name: N-[3-chloro-2-(phenylmethyl)-1-piperazinyl]-N-propan-2-yl-3H-benzimidazole-5-carboxamide IUPAC Name: N-(2-benzyl-3-chloropiperazin-1-yl)-N-propan-2-yl-3H-benzimidazole-5-carboxamide Traditional Name: N-(2-benzyl-3-chloro-piperazino)-N-isopropyl-3H-benzimidazole-5-carboxamide Formula: C22H26ClN5O MolecularWeight: 411.92774

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C(=O)C1=CC2=C(C=C1)N=CN2)N3CCNC(C3CC4=CC=CC=C4)Cl

Isomeric SMILES

CC(C)N(C(=O)C1=CC2=C(C=C1)N=CN2)N3CCNC(C3CC4=CC=CC=C4)Cl

InChI

InChI=1S/C22H26ClN5O/c1-15(2)28(22(29)17-8-9-18-19(13-17)26-14-25-18)27-11-10-24-21(23)20(27)12-16-6-4-3-5-7-16/h3-9,13-15,20-21,24H,10-12H2,1-2H3,(H,25,26)