(E)-2-(4-methylphenyl)carbonyl-3-(pyridin-2-ylamino)but-2-enenitrile

Systemtic Name: (E)-2-(4-methylphenyl)carbonyl-3-(pyridin-2-ylamino)but-2-enenitrile Openeye Name: (E)-2-(4-methylbenzoyl)-3-(2-pyridylamino)but-2-enenitrile CAS Name: (E)-2-[(4-methylphenyl)-oxomethyl]-3-(2-pyridinylamino)-2-butenenitrile IUPAC Name: (E)-2-(4-methylbenzoyl)-3-(pyridin-2-ylamino)but-2-enenitrile Traditional Name: (E)-2-p-toluoyl-3-(2-pyridylamino)but-2-enenitrile Formula: C17H15N3O MolecularWeight: 277.3205

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C(=C(C)NC2=CC=CC=N2)C#N

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)/C(=C(\C)/NC2=CC=CC=N2)/C#N

InChI

InChI=1S/C17H15N3O/c1-12-6-8-14(9-7-12)17(21)15(11-18)13(2)20-16-5-3-4-10-19-16/h3-10H,1-2H3,(H,19,20)/b15-13+