1,1-bis(2-cyanoethyl)-3-(3,5-dimethylphenyl)urea

Systemtic Name: 1,1-bis(2-cyanoethyl)-3-(3,5-dimethylphenyl)urea Openeye Name: 1,1-bis(2-cyanoethyl)-3-(3,5-dimethylphenyl)urea CAS Name: 1,1-bis(2-cyanoethyl)-3-(3,5-dimethylphenyl)urea IUPAC Name: 1,1-bis(2-cyanoethyl)-3-(3,5-dimethylphenyl)urea Traditional Name: 1,1-bis(2-cyanoethyl)-3-(3,5-dimethylphenyl)urea Formula: C15H18N4O MolecularWeight: 270.32962

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=O)N(CCC#N)CCC#N)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=O)N(CCC#N)CCC#N)C

InChI

InChI=1S/C15H18N4O/c1-12-9-13(2)11-14(10-12)18-15(20)19(7-3-5-16)8-4-6-17/h9-11H,3-4,7-8H2,1-2H3,(H,18,20)