1-(2-cyanoethyl)-3-(2,6-diethylphenyl)-1-(phenylmethyl)urea

Systemtic Name: 1-(2-cyanoethyl)-3-(2,6-diethylphenyl)-1-(phenylmethyl)urea Openeye Name: 1-benzyl-1-(2-cyanoethyl)-3-(2,6-diethylphenyl)urea CAS Name: 1-(2-cyanoethyl)-3-(2,6-diethylphenyl)-1-(phenylmethyl)urea IUPAC Name: 1-benzyl-1-(2-cyanoethyl)-3-(2,6-diethylphenyl)urea Traditional Name: 1-benzyl-1-(2-cyanoethyl)-3-(2,6-diethylphenyl)urea Formula: C21H25N3O MolecularWeight: 335.4427

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC(=O)N(CCC#N)CC2=CC=CC=C2

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=O)N(CCC#N)CC2=CC=CC=C2

InChI

InChI=1S/C21H25N3O/c1-3-18-12-8-13-19(4-2)20(18)23-21(25)24(15-9-14-22)16-17-10-6-5-7-11-17/h5-8,10-13H,3-4,9,15-16H2,1-2H3,(H,23,25)