N-[2-[(4-ethylpiperazin-4-ium-1-yl)methyl]-1-propan-2-yl-benzimidazol-5-yl]butanamide

Systemtic Name: N-[2-[(4-ethylpiperazin-4-ium-1-yl)methyl]-1-propan-2-yl-benzimidazol-5-yl]butanamide Openeye Name: N-[2-[(4-ethylpiperazin-4-ium-1-yl)methyl]-1-isopropyl-benzimidazol-5-yl]butanamide CAS Name: N-[2-[(4-ethyl-1-piperazin-4-iumyl)methyl]-1-propan-2-yl-5-benzimidazolyl]butanamide IUPAC Name: N-[2-[(4-ethylpiperazin-4-ium-1-yl)methyl]-1-propan-2-ylbenzimidazol-5-yl]butanamide Traditional Name: N-[2-[(4-ethylpiperazin-4-ium-1-yl)methyl]-1-isopropyl-benzimidazol-5-yl]butyramide Formula: C21H34N5O+ MolecularWeight: 372.52756

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC2=C(C=C1)N(C(=N2)CN3CC[NH+](CC3)CC)C(C)C

Isomeric SMILES

CCCC(=O)NC1=CC2=C(C=C1)N(C(=N2)CN3CC[NH+](CC3)CC)C(C)C

InChI

InChI=1S/C21H33N5O/c1-5-7-21(27)22-17-8-9-19-18(14-17)23-20(26(19)16(3)4)15-25-12-10-24(6-2)11-13-25/h8-9,14,16H,5-7,10-13,15H2,1-4H3,(H,22,27)/p+1