(E)-3-[2,5-dimethyl-1-(2-propan-2-ylpyrazol-3-yl)pyrrol-3-yl]-N-(2-thiophen-2-ylethyl)prop-2-enamide

Systemtic Name: (E)-3-[2,5-dimethyl-1-(2-propan-2-ylpyrazol-3-yl)pyrrol-3-yl]-N-(2-thiophen-2-ylethyl)prop-2-enamide Openeye Name: (E)-3-[1-(2-isopropylpyrazol-3-yl)-2,5-dimethyl-pyrrol-3-yl]-N-[2-(2-thienyl)ethyl]prop-2-enamide CAS Name: (E)-3-[2,5-dimethyl-1-(2-propan-2-yl-3-pyrazolyl)-3-pyrrolyl]-N-(2-thiophen-2-ylethyl)-2-propenamide IUPAC Name: (E)-3-[2,5-dimethyl-1-(2-propan-2-ylpyrazol-3-yl)pyrrol-3-yl]-N-(2-thiophen-2-ylethyl)prop-2-enamide Traditional Name: (E)-3-[1-(2-isopropylpyrazol-3-yl)-2,5-dimethyl-pyrrol-3-yl]-N-[2-(2-thienyl)ethyl]acrylamide Formula: C21H26N4OS MolecularWeight: 382.52234

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=NN2C(C)C)C)C=CC(=O)NCCC3=CC=CS3

Isomeric SMILES

CC1=CC(=C(N1C2=CC=NN2C(C)C)C)/C=C/C(=O)NCCC3=CC=CS3

InChI

InChI=1S/C21H26N4OS/c1-15(2)25-21(10-12-23-25)24-16(3)14-18(17(24)4)7-8-20(26)22-11-9-19-6-5-13-27-19/h5-8,10,12-15H,9,11H2,1-4H3,(H,22,26)/b8-7+