2-[4-(1-propan-2-ylbenzimidazol-2-yl)piperazin-1-ium-1-yl]-N-(thiophen-2-ylmethyl)ethanamide

Systemtic Name: 2-[4-(1-propan-2-ylbenzimidazol-2-yl)piperazin-1-ium-1-yl]-N-(thiophen-2-ylmethyl)ethanamide Openeye Name: 2-[4-(1-isopropylbenzimidazol-2-yl)piperazin-1-ium-1-yl]-N-(2-thienylmethyl)acetamide CAS Name: 2-[4-(1-propan-2-yl-2-benzimidazolyl)-1-piperazin-1-iumyl]-N-(thiophen-2-ylmethyl)acetamide IUPAC Name: 2-[4-(1-propan-2-ylbenzimidazol-2-yl)piperazin-1-ium-1-yl]-N-(thiophen-2-ylmethyl)acetamide Traditional Name: 2-[4-(1-isopropylbenzimidazol-2-yl)piperazin-1-ium-1-yl]-N-(2-thenyl)acetamide Formula: C21H28N5OS+ MolecularWeight: 398.54492

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C2=CC=CC=C2N=C1N3CC[NH+](CC3)CC(=O)NCC4=CC=CS4

Isomeric SMILES

CC(C)N1C2=CC=CC=C2N=C1N3CC[NH+](CC3)CC(=O)NCC4=CC=CS4

InChI

InChI=1S/C21H27N5OS/c1-16(2)26-19-8-4-3-7-18(19)23-21(26)25-11-9-24(10-12-25)15-20(27)22-14-17-6-5-13-28-17/h3-8,13,16H,9-12,14-15H2,1-2H3,(H,22,27)/p+1