(E)-3-[1-(phenylmethyl)pyrazol-4-yl]-N-(2-phenylsulfanylethyl)prop-2-enamide

Systemtic Name: (E)-3-[1-(phenylmethyl)pyrazol-4-yl]-N-(2-phenylsulfanylethyl)prop-2-enamide Openeye Name: (E)-3-(1-benzylpyrazol-4-yl)-N-(2-phenylsulfanylethyl)prop-2-enamide CAS Name: (E)-3-[1-(phenylmethyl)-4-pyrazolyl]-N-[2-(phenylthio)ethyl]-2-propenamide IUPAC Name: (E)-3-(1-benzylpyrazol-4-yl)-N-(2-phenylsulfanylethyl)prop-2-enamide Traditional Name: (E)-3-(1-benzylpyrazol-4-yl)-N-[2-(phenylthio)ethyl]acrylamide Formula: C21H21N3OS MolecularWeight: 363.47594

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=C(C=N2)C=CC(=O)NCCSC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CN2C=C(C=N2)/C=C/C(=O)NCCSC3=CC=CC=C3

InChI

InChI=1S/C21H21N3OS/c25-21(22-13-14-26-20-9-5-2-6-10-20)12-11-19-15-23-24(17-19)16-18-7-3-1-4-8-18/h1-12,15,17H,13-14,16H2,(H,22,25)/b12-11+