(E)-N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-N-methyl-3-phenylsulfanyl-prop-2-enamide

Systemtic Name: (E)-N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-N-methyl-3-phenylsulfanyl-prop-2-enamide Openeye Name: (E)-N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-N-methyl-3-phenylsulfanyl-prop-2-enamide CAS Name: (E)-N-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)methyl]-N-methyl-3-(phenylthio)-2-propenamide IUPAC Name: (E)-N-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl]-N-methyl-3-phenylsulfanylprop-2-enamide Traditional Name: (E)-N-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]-N-methyl-3-(phenylthio)acrylamide Formula: C22H23N3OS MolecularWeight: 377.50252

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)CN(C)C(=O)C=CSC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)CN(C)C(=O)/C=C/SC3=CC=CC=C3

InChI

InChI=1S/C22H23N3OS/c1-17-21(18(2)25(23-17)19-10-6-4-7-11-19)16-24(3)22(26)14-15-27-20-12-8-5-9-13-20/h4-15H,16H2,1-3H3/b15-14+