(Z)-2-(4-nitrophenyl)-3-[1-(phenylmethyl)-3-thiophen-2-yl-pyrazol-4-yl]prop-2-enenitrile

Systemtic Name: (Z)-2-(4-nitrophenyl)-3-[1-(phenylmethyl)-3-thiophen-2-yl-pyrazol-4-yl]prop-2-enenitrile Openeye Name: (Z)-3-[1-benzyl-3-(2-thienyl)pyrazol-4-yl]-2-(4-nitrophenyl)prop-2-enenitrile CAS Name: (Z)-2-(4-nitrophenyl)-3-[1-(phenylmethyl)-3-thiophen-2-yl-4-pyrazolyl]-2-propenenitrile IUPAC Name: (Z)-3-(1-benzyl-3-thiophen-2-ylpyrazol-4-yl)-2-(4-nitrophenyl)prop-2-enenitrile Traditional Name: (Z)-3-[1-benzyl-3-(2-thienyl)pyrazol-4-yl]-2-(4-nitrophenyl)acrylonitrile Formula: C23H16N4O2S MolecularWeight: 412.46374

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=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)CN2C=C(C(=N2)C3=CC=CS3)/C=C(\C#N)/C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H16N4O2S/c24-14-19(18-8-10-21(11-9-18)27(28)29)13-20-16-26(15-17-5-2-1-3-6-17)25-23(20)22-7-4-12-30-22/h1-13,16H,15H2/b19-13+