(E)-3-(1-methylpyrazol-4-yl)-N-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]prop-2-enamide

Systemtic Name: (E)-3-(1-methylpyrazol-4-yl)-N-[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]prop-2-enamide Openeye Name: (E)-N-[2-(benzylamino)-2-oxo-ethyl]-3-(1-methylpyrazol-4-yl)prop-2-enamide CAS Name: (E)-3-(1-methyl-4-pyrazolyl)-N-[2-oxo-2-[(phenylmethyl)amino]ethyl]-2-propenamide IUPAC Name: (E)-N-[2-(benzylamino)-2-oxoethyl]-3-(1-methylpyrazol-4-yl)prop-2-enamide Traditional Name: (E)-N-[2-(benzylamino)-2-keto-ethyl]-3-(1-methylpyrazol-4-yl)acrylamide Formula: C16H18N4O2 MolecularWeight: 298.33972

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)C=CC(=O)NCC(=O)NCC2=CC=CC=C2

Isomeric SMILES

CN1C=C(C=N1)/C=C/C(=O)NCC(=O)NCC2=CC=CC=C2

InChI

InChI=1S/C16H18N4O2/c1-20-12-14(10-19-20)7-8-15(21)18-11-16(22)17-9-13-5-3-2-4-6-13/h2-8,10,12H,9,11H2,1H3,(H,17,22)(H,18,21)/b8-7+