3-[1-(2-cyanoethyl)-3,5-dimethyl-pyrazol-4-yl]-N-(5-methylhexan-2-yl)propanamide

Systemtic Name: 3-[1-(2-cyanoethyl)-3,5-dimethyl-pyrazol-4-yl]-N-(5-methylhexan-2-yl)propanamide Openeye Name: 3-[1-(2-cyanoethyl)-3,5-dimethyl-pyrazol-4-yl]-N-(1,4-dimethylpentyl)propanamide CAS Name: 3-[1-(2-cyanoethyl)-3,5-dimethyl-4-pyrazolyl]-N-(5-methylhexan-2-yl)propanamide IUPAC Name: 3-[1-(2-cyanoethyl)-3,5-dimethylpyrazol-4-yl]-N-(5-methylhexan-2-yl)propanamide Traditional Name: 3-[1-(2-cyanoethyl)-3,5-dimethyl-pyrazol-4-yl]-N-(1,4-dimethylpentyl)propionamide Formula: C18H30N4O MolecularWeight: 318.457

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CCC#N)C)CCC(=O)NC(C)CCC(C)C

Isomeric SMILES

CC1=C(C(=NN1CCC#N)C)CCC(=O)NC(C)CCC(C)C

InChI

InChI=1S/C18H30N4O/c1-13(2)7-8-14(3)20-18(23)10-9-17-15(4)21-22(16(17)5)12-6-11-19/h13-14H,6-10,12H2,1-5H3,(H,20,23)