1-(2-cyano-3,3-dimethyl-4H-naphthalen-1-yl)-3-(2-methylphenyl)urea

Systemtic Name: 1-(2-cyano-3,3-dimethyl-4H-naphthalen-1-yl)-3-(2-methylphenyl)urea Openeye Name: 1-(2-cyano-3,3-dimethyl-4H-naphthalen-1-yl)-3-(o-tolyl)urea CAS Name: 1-(2-cyano-3,3-dimethyl-4H-naphthalen-1-yl)-3-(2-methylphenyl)urea IUPAC Name: 1-(2-cyano-3,3-dimethyl-4H-naphthalen-1-yl)-3-(2-methylphenyl)urea Traditional Name: 1-(2-cyano-3,3-dimethyl-4H-naphthalen-1-yl)-3-(o-tolyl)urea Formula: C21H21N3O MolecularWeight: 331.41094

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)NC2=C(C(CC3=CC=CC=C32)(C)C)C#N

Isomeric SMILES

CC1=CC=CC=C1NC(=O)NC2=C(C(CC3=CC=CC=C32)(C)C)C#N

InChI

InChI=1S/C21H21N3O/c1-14-8-4-7-11-18(14)23-20(25)24-19-16-10-6-5-9-15(16)12-21(2,3)17(19)13-22/h4-11H,12H2,1-3H3,(H2,23,24,25)