N-(3-imidazol-1-ylpropyl)-1-(1-prop-2-enylbenzimidazol-2-yl)piperidine-4-carboxamide

Systemtic Name: N-(3-imidazol-1-ylpropyl)-1-(1-prop-2-enylbenzimidazol-2-yl)piperidine-4-carboxamide Openeye Name: 1-(1-allylbenzimidazol-2-yl)-N-(3-imidazol-1-ylpropyl)piperidine-4-carboxamide CAS Name: N-[3-(1-imidazolyl)propyl]-1-(1-prop-2-enyl-2-benzimidazolyl)-4-piperidinecarboxamide IUPAC Name: N-(3-imidazol-1-ylpropyl)-1-(1-prop-2-enylbenzimidazol-2-yl)piperidine-4-carboxamide Traditional Name: 1-(1-allylbenzimidazol-2-yl)-N-(3-imidazol-1-ylpropyl)isonipecotamide Formula: C22H28N6O MolecularWeight: 392.49732

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C2=CC=CC=C2N=C1N3CCC(CC3)C(=O)NCCCN4C=CN=C4

Isomeric SMILES

C=CCN1C2=CC=CC=C2N=C1N3CCC(CC3)C(=O)NCCCN4C=CN=C4

InChI

InChI=1S/C22H28N6O/c1-2-12-28-20-7-4-3-6-19(20)25-22(28)27-14-8-18(9-15-27)21(29)24-10-5-13-26-16-11-23-17-26/h2-4,6-7,11,16-18H,1,5,8-10,12-15H2,(H,24,29)