(E)-2-cyano-3-[5-(4-ethylphenyl)-1H-pyrazol-4-yl]-N-(thiophen-2-ylmethyl)prop-2-enamide

Systemtic Name: (E)-2-cyano-3-[5-(4-ethylphenyl)-1H-pyrazol-4-yl]-N-(thiophen-2-ylmethyl)prop-2-enamide Openeye Name: (E)-2-cyano-3-[5-(4-ethylphenyl)-1H-pyrazol-4-yl]-N-(2-thienylmethyl)prop-2-enamide CAS Name: (E)-2-cyano-3-[5-(4-ethylphenyl)-1H-pyrazol-4-yl]-N-(thiophen-2-ylmethyl)-2-propenamide IUPAC Name: (E)-2-cyano-3-[5-(4-ethylphenyl)-1H-pyrazol-4-yl]-N-(thiophen-2-ylmethyl)prop-2-enamide Traditional Name: (E)-2-cyano-3-[5-(4-ethylphenyl)-1H-pyrazol-4-yl]-N-(2-thenyl)acrylamide Formula: C20H18N4OS MolecularWeight: 362.44812

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=C(C=NN2)C=C(C#N)C(=O)NCC3=CC=CS3

Isomeric SMILES

CCC1=CC=C(C=C1)C2=C(C=NN2)/C=C(\C#N)/C(=O)NCC3=CC=CS3

InChI

InChI=1S/C20H18N4OS/c1-2-14-5-7-15(8-6-14)19-17(12-23-24-19)10-16(11-21)20(25)22-13-18-4-3-9-26-18/h3-10,12H,2,13H2,1H3,(H,22,25)(H,23,24)/b16-10+