(E)-3-[3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]-2-(4-thiophen-2-yl-1,3-thiazol-2-yl)prop-2-enenitrile

Systemtic Name: (E)-3-[3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]-2-(4-thiophen-2-yl-1,3-thiazol-2-yl)prop-2-enenitrile Openeye Name: (E)-3-[3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]-2-[4-(2-thienyl)thiazol-2-yl]prop-2-enenitrile CAS Name: (E)-3-[3-(4-methoxyphenyl)-1-phenyl-4-pyrazolyl]-2-(4-thiophen-2-yl-2-thiazolyl)-2-propenenitrile IUPAC Name: (E)-3-[3-(4-methoxyphenyl)-1-phenylpyrazol-4-yl]-2-(4-thiophen-2-yl-1,3-thiazol-2-yl)prop-2-enenitrile Traditional Name: (E)-3-[3-(4-methoxyphenyl)-1-phenyl-pyrazol-4-yl]-2-[4-(2-thienyl)thiazol-2-yl]acrylonitrile Formula: C26H18N4OS2 MolecularWeight: 466.57732

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN(C=C2C=C(C#N)C3=NC(=CS3)C4=CC=CS4)C5=CC=CC=C5

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN(C=C2/C=C(\C#N)/C3=NC(=CS3)C4=CC=CS4)C5=CC=CC=C5

InChI

InChI=1S/C26H18N4OS2/c1-31-22-11-9-18(10-12-22)25-20(16-30(29-25)21-6-3-2-4-7-21)14-19(15-27)26-28-23(17-33-26)24-8-5-13-32-24/h2-14,16-17H,1H3/b19-14+