3-[1-[2-[(2-cyclopentyl-5-methyl-pyrazol-3-yl)amino]-2-oxidanylidene-ethyl]-3,5-dimethyl-pyrazol-4-yl]propyl-dimethyl-azanium

Systemtic Name: 3-[1-[2-[(2-cyclopentyl-5-methyl-pyrazol-3-yl)amino]-2-oxidanylidene-ethyl]-3,5-dimethyl-pyrazol-4-yl]propyl-dimethyl-azanium Openeye Name: 3-[1-[2-[(2-cyclopentyl-5-methyl-pyrazol-3-yl)amino]-2-oxo-ethyl]-3,5-dimethyl-pyrazol-4-yl]propyl-dimethyl-ammonium CAS Name: 3-[1-[2-[(2-cyclopentyl-5-methyl-3-pyrazolyl)amino]-2-oxoethyl]-3,5-dimethyl-4-pyrazolyl]propyl-dimethylammonium IUPAC Name: 3-[1-[2-[(2-cyclopentyl-5-methylpyrazol-3-yl)amino]-2-oxoethyl]-3,5-dimethylpyrazol-4-yl]propyl-dimethylazanium Traditional Name: 3-[1-[2-[(2-cyclopentyl-5-methyl-pyrazol-3-yl)amino]-2-keto-ethyl]-3,5-dimethyl-pyrazol-4-yl]propyl-dimethyl-ammonium Formula: C21H35N6O+ MolecularWeight: 387.5422

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)NC(=O)CN2C(=C(C(=N2)C)CCC[NH+](C)C)C)C3CCCC3

Isomeric SMILES

CC1=NN(C(=C1)NC(=O)CN2C(=C(C(=N2)C)CCC[NH+](C)C)C)C3CCCC3

InChI

InChI=1S/C21H34N6O/c1-15-13-20(27(23-15)18-9-6-7-10-18)22-21(28)14-26-17(3)19(16(2)24-26)11-8-12-25(4)5/h13,18H,6-12,14H2,1-5H3,(H,22,28)/p+1