1-(2-cyanoethyl)-3-pentyl-1-(phenylmethyl)urea

Systemtic Name: 1-(2-cyanoethyl)-3-pentyl-1-(phenylmethyl)urea Openeye Name: 1-benzyl-1-(2-cyanoethyl)-3-pentyl-urea CAS Name: 1-(2-cyanoethyl)-3-pentyl-1-(phenylmethyl)urea IUPAC Name: 1-benzyl-1-(2-cyanoethyl)-3-pentylurea Traditional Name: 3-amyl-1-benzyl-1-(2-cyanoethyl)urea Formula: C16H23N3O MolecularWeight: 273.37332

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)N(CCC#N)CC1=CC=CC=C1

Isomeric SMILES

CCCCCNC(=O)N(CCC#N)CC1=CC=CC=C1

InChI

InChI=1S/C16H23N3O/c1-2-3-7-12-18-16(20)19(13-8-11-17)14-15-9-5-4-6-10-15/h4-6,9-10H,2-3,7-8,12-14H2,1H3,(H,18,20)