2-cyano-3-cyclopropyl-N-[1-(2,4-dimethylphenyl)ethyl]-3-ethyl-pentanamide

Systemtic Name: 2-cyano-3-cyclopropyl-N-[1-(2,4-dimethylphenyl)ethyl]-3-ethyl-pentanamide Openeye Name: 2-cyano-3-cyclopropyl-N-[1-(2,4-dimethylphenyl)ethyl]-3-ethyl-pentanamide CAS Name: 2-cyano-3-cyclopropyl-N-[1-(2,4-dimethylphenyl)ethyl]-3-ethylpentanamide IUPAC Name: 2-cyano-3-cyclopropyl-N-[1-(2,4-dimethylphenyl)ethyl]-3-ethylpentanamide Traditional Name: 2-cyano-3-cyclopropyl-N-[1-(2,4-dimethylphenyl)ethyl]-3-ethyl-valeramide Formula: C21H30N2O MolecularWeight: 326.4757

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C1CC1)C(C#N)C(=O)NC(C)C2=C(C=C(C=C2)C)C

Isomeric SMILES

CCC(CC)(C1CC1)C(C#N)C(=O)NC(C)C2=C(C=C(C=C2)C)C

InChI

InChI=1S/C21H30N2O/c1-6-21(7-2,17-9-10-17)19(13-22)20(24)23-16(5)18-11-8-14(3)12-15(18)4/h8,11-12,16-17,19H,6-7,9-10H2,1-5H3,(H,23,24)