2-(4-nitrophenyl)-3-(1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)prop-2-enenitrile

Systemtic Name: 2-(4-nitrophenyl)-3-(1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)prop-2-enenitrile Openeye Name: 2-(4-nitrophenyl)-3-[1-phenyl-3-(2-thienyl)pyrazol-4-yl]prop-2-enenitrile CAS Name: 2-(4-nitrophenyl)-3-(1-phenyl-3-thiophen-2-yl-4-pyrazolyl)-2-propenenitrile IUPAC Name: 2-(4-nitrophenyl)-3-(1-phenyl-3-thiophen-2-ylpyrazol-4-yl)prop-2-enenitrile Traditional Name: 2-(4-nitrophenyl)-3-[1-phenyl-3-(2-thienyl)pyrazol-4-yl]acrylonitrile Formula: C22H14N4O2S MolecularWeight: 398.43716

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=CS3)C=C(C#N)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=CS3)C=C(C#N)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H14N4O2S/c23-14-17(16-8-10-20(11-9-16)26(27)28)13-18-15-25(19-5-2-1-3-6-19)24-22(18)21-7-4-12-29-21/h1-13,15H