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

Systemtic Name: N-phenethyl-N-(phenylmethyl)-3-(1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)prop-2-enamide Openeye Name: N-benzyl-N-phenethyl-3-[1-phenyl-3-(2-thienyl)pyrazol-4-yl]prop-2-enamide CAS Name: N-phenethyl-N-(phenylmethyl)-3-(1-phenyl-3-thiophen-2-yl-4-pyrazolyl)-2-propenamide IUPAC Name: N-benzyl-N-phenethyl-3-(1-phenyl-3-thiophen-2-ylpyrazol-4-yl)prop-2-enamide Traditional Name: N-benzyl-N-phenethyl-3-[1-phenyl-3-(2-thienyl)pyrazol-4-yl]acrylamide Formula: C31H27N3OS MolecularWeight: 489.63058

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN(CC2=CC=CC=C2)C(=O)C=CC3=CN(N=C3C4=CC=CS4)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)CCN(CC2=CC=CC=C2)C(=O)C=CC3=CN(N=C3C4=CC=CS4)C5=CC=CC=C5

InChI

InChI=1S/C31H27N3OS/c35-30(33(23-26-13-6-2-7-14-26)21-20-25-11-4-1-5-12-25)19-18-27-24-34(28-15-8-3-9-16-28)32-31(27)29-17-10-22-36-29/h1-19,22,24H,20-21,23H2