1-(2-cyanoethyl)-3-(3-methylphenyl)-1-(pyridin-3-ylmethyl)urea

Systemtic Name: 1-(2-cyanoethyl)-3-(3-methylphenyl)-1-(pyridin-3-ylmethyl)urea Openeye Name: 1-(2-cyanoethyl)-3-(m-tolyl)-1-(3-pyridylmethyl)urea CAS Name: 1-(2-cyanoethyl)-3-(3-methylphenyl)-1-(3-pyridinylmethyl)urea IUPAC Name: 1-(2-cyanoethyl)-3-(3-methylphenyl)-1-(pyridin-3-ylmethyl)urea Traditional Name: 1-(2-cyanoethyl)-3-(m-tolyl)-1-(3-pyridylmethyl)urea Formula: C17H18N4O MolecularWeight: 294.35102

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18N4O/c1-14-5-2-7-16(11-14)20-17(22)21(10-4-8-18)13-15-6-3-9-19-12-15/h2-3,5-7,9,11-12H,4,10,13H2,1H3,(H,20,22)