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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)CC2=NC3=C(N2C(C)C)C=CC(=C3)NC(=O)C(C)C

Isomeric SMILES

CC[NH+]1CCN(CC1)CC2=NC3=C(N2C(C)C)C=CC(=C3)NC(=O)C(C)C

InChI

InChI=1S/C21H33N5O/c1-6-24-9-11-25(12-10-24)14-20-23-18-13-17(22-21(27)15(2)3)7-8-19(18)26(20)16(4)5/h7-8,13,15-16H,6,9-12,14H2,1-5H3,(H,22,27)/p+1