2-cyano-N-(phenylmethyl)-3-(1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)prop-2-enamide

Systemtic Name: 2-cyano-N-(phenylmethyl)-3-(1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)prop-2-enamide Openeye Name: N-benzyl-2-cyano-3-[1-phenyl-3-(2-thienyl)pyrazol-4-yl]prop-2-enamide CAS Name: 2-cyano-N-(phenylmethyl)-3-(1-phenyl-3-thiophen-2-yl-4-pyrazolyl)-2-propenamide IUPAC Name: N-benzyl-2-cyano-3-(1-phenyl-3-thiophen-2-ylpyrazol-4-yl)prop-2-enamide Traditional Name: N-benzyl-2-cyano-3-[1-phenyl-3-(2-thienyl)pyrazol-4-yl]acrylamide Formula: C24H18N4OS MolecularWeight: 410.49092

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)C(=CC2=CN(N=C2C3=CC=CS3)C4=CC=CC=C4)C#N

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)C(=CC2=CN(N=C2C3=CC=CS3)C4=CC=CC=C4)C#N

InChI

InChI=1S/C24H18N4OS/c25-15-19(24(29)26-16-18-8-3-1-4-9-18)14-20-17-28(21-10-5-2-6-11-21)27-23(20)22-12-7-13-30-22/h1-14,17H,16H2,(H,26,29)