N-(3H-benzimidazol-5-ylmethyl)-2-[3-[(1-cyclopentylpyrrolidin-1-ium-1-yl)methylamino]-6-methyl-2-oxidanylidene-pyrazin-1-yl]ethanamide

Systemtic Name: N-(3H-benzimidazol-5-ylmethyl)-2-[3-[(1-cyclopentylpyrrolidin-1-ium-1-yl)methylamino]-6-methyl-2-oxidanylidene-pyrazin-1-yl]ethanamide Openeye Name: N-(3H-benzimidazol-5-ylmethyl)-2-[3-[(1-cyclopentylpyrrolidin-1-ium-1-yl)methylamino]-6-methyl-2-oxo-pyrazin-1-yl]acetamide CAS Name: N-(3H-benzimidazol-5-ylmethyl)-2-[3-[(1-cyclopentyl-1-pyrrolidin-1-iumyl)methylamino]-6-methyl-2-oxo-1-pyrazinyl]acetamide IUPAC Name: N-(3H-benzimidazol-5-ylmethyl)-2-[3-[(1-cyclopentylpyrrolidin-1-ium-1-yl)methylamino]-6-methyl-2-oxopyrazin-1-yl]acetamide Traditional Name: N-(3H-benzimidazol-5-ylmethyl)-2-[3-[(1-cyclopentylpyrrolidin-1-ium-1-yl)methylamino]-2-keto-6-methyl-pyrazin-1-yl]acetamide Formula: C25H34N7O2+ MolecularWeight: 464.58316

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C(=O)N1CC(=O)NCC2=CC3=C(C=C2)N=CN3)NC[N+]4(CCCC4)C5CCCC5

Isomeric SMILES

CC1=CN=C(C(=O)N1CC(=O)NCC2=CC3=C(C=C2)N=CN3)NC[N+]4(CCCC4)C5CCCC5

InChI

InChI=1S/C25H33N7O2/c1-18-13-27-24(30-17-32(10-4-5-11-32)20-6-2-3-7-20)25(34)31(18)15-23(33)26-14-19-8-9-21-22(12-19)29-16-28-21/h8-9,12-13,16,20H,2-7,10-11,14-15,17H2,1H3,(H2-,26,27,28,29,30,33)/p+1