N,N-bis(3-methylbutyl)-3-(3-piperidin-1-ylpropyl)-2-(thiophen-3-ylmethylamino)benzimidazole-5-carboxamide

Systemtic Name: N,N-bis(3-methylbutyl)-3-(3-piperidin-1-ylpropyl)-2-(thiophen-3-ylmethylamino)benzimidazole-5-carboxamide Openeye Name: N,N-diisopentyl-3-[3-(1-piperidyl)propyl]-2-(3-thienylmethylamino)benzimidazole-5-carboxamide CAS Name: N,N-bis(3-methylbutyl)-3-[3-(1-piperidinyl)propyl]-2-(3-thiophenylmethylamino)-5-benzimidazolecarboxamide IUPAC Name: N,N-bis(3-methylbutyl)-3-(3-piperidin-1-ylpropyl)-2-(thiophen-3-ylmethylamino)benzimidazole-5-carboxamide Traditional Name: N,N-diisoamyl-3-(3-piperidinopropyl)-2-(3-thenylamino)benzimidazole-5-carboxamide Formula: C31H47N5OS MolecularWeight: 537.80278

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN(CCC(C)C)C(=O)C1=CC2=C(C=C1)N=C(N2CCCN3CCCCC3)NCC4=CSC=C4

Isomeric SMILES

CC(C)CCN(CCC(C)C)C(=O)C1=CC2=C(C=C1)N=C(N2CCCN3CCCCC3)NCC4=CSC=C4

InChI

InChI=1S/C31H47N5OS/c1-24(2)11-18-35(19-12-25(3)4)30(37)27-9-10-28-29(21-27)36(17-8-16-34-14-6-5-7-15-34)31(33-28)32-22-26-13-20-38-23-26/h9-10,13,20-21,23-25H,5-8,11-12,14-19,22H2,1-4H3,(H,32,33)