N-(cyanomethyl)-2-(cyclohexylmethyl)-N'-phenethyl-propanediamide

Systemtic Name: N-(cyanomethyl)-2-(cyclohexylmethyl)-N'-phenethyl-propanediamide Openeye Name: N-(cyanomethyl)-2-(cyclohexylmethyl)-N'-phenethyl-propanediamide CAS Name: N-(cyanomethyl)-2-(cyclohexylmethyl)-N'-phenethylpropanediamide IUPAC Name: N-(cyanomethyl)-2-(cyclohexylmethyl)-N'-phenethylpropanediamide Traditional Name: N-(cyanomethyl)-2-(cyclohexylmethyl)-N'-phenethyl-malonamide Formula: C20H27N3O2 MolecularWeight: 341.44728

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CC(C(=O)NCCC2=CC=CC=C2)C(=O)NCC#N

Isomeric SMILES

C1CCC(CC1)CC(C(=O)NCCC2=CC=CC=C2)C(=O)NCC#N

InChI

InChI=1S/C20H27N3O2/c21-12-14-23-20(25)18(15-17-9-5-2-6-10-17)19(24)22-13-11-16-7-3-1-4-8-16/h1,3-4,7-8,17-18H,2,5-6,9-11,13-15H2,(H,22,24)(H,23,25)