(E)-N-[2-(4-chlorophenyl)sulfanylphenyl]-3-(1-ethyl-5-methyl-pyrazol-4-yl)prop-2-enamide

Systemtic Name: (E)-N-[2-(4-chlorophenyl)sulfanylphenyl]-3-(1-ethyl-5-methyl-pyrazol-4-yl)prop-2-enamide Openeye Name: (E)-N-[2-(4-chlorophenyl)sulfanylphenyl]-3-(1-ethyl-5-methyl-pyrazol-4-yl)prop-2-enamide CAS Name: (E)-N-[2-[(4-chlorophenyl)thio]phenyl]-3-(1-ethyl-5-methyl-4-pyrazolyl)-2-propenamide IUPAC Name: (E)-N-[2-(4-chlorophenyl)sulfanylphenyl]-3-(1-ethyl-5-methylpyrazol-4-yl)prop-2-enamide Traditional Name: (E)-N-[2-[(4-chlorophenyl)thio]phenyl]-3-(1-ethyl-5-methyl-pyrazol-4-yl)acrylamide Formula: C21H20ClN3OS MolecularWeight: 397.921

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C=N1)C=CC(=O)NC2=CC=CC=C2SC3=CC=C(C=C3)Cl)C

Isomeric SMILES

CCN1C(=C(C=N1)/C=C/C(=O)NC2=CC=CC=C2SC3=CC=C(C=C3)Cl)C

InChI

InChI=1S/C21H20ClN3OS/c1-3-25-15(2)16(14-23-25)8-13-21(26)24-19-6-4-5-7-20(19)27-18-11-9-17(22)10-12-18/h4-14H,3H2,1-2H3,(H,24,26)/b13-8+