1-(2-cyanoethyl)-3-(3,4-dimethylphenyl)-1-(pyridin-3-ylmethyl)urea

Systemtic Name: 1-(2-cyanoethyl)-3-(3,4-dimethylphenyl)-1-(pyridin-3-ylmethyl)urea Openeye Name: 1-(2-cyanoethyl)-3-(3,4-dimethylphenyl)-1-(3-pyridylmethyl)urea CAS Name: 1-(2-cyanoethyl)-3-(3,4-dimethylphenyl)-1-(3-pyridinylmethyl)urea IUPAC Name: 1-(2-cyanoethyl)-3-(3,4-dimethylphenyl)-1-(pyridin-3-ylmethyl)urea Traditional Name: 1-(2-cyanoethyl)-3-(3,4-dimethylphenyl)-1-(3-pyridylmethyl)urea Formula: C18H20N4O MolecularWeight: 308.3776

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)N(CCC#N)CC2=CN=CC=C2)C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)N(CCC#N)CC2=CN=CC=C2)C

InChI

InChI=1S/C18H20N4O/c1-14-6-7-17(11-15(14)2)21-18(23)22(10-4-8-19)13-16-5-3-9-20-12-16/h3,5-7,9,11-12H,4,10,13H2,1-2H3,(H,21,23)