(E)-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-3-(5-phenyl-1H-pyrazol-4-yl)prop-2-enenitrile

Systemtic Name: (E)-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-3-(5-phenyl-1H-pyrazol-4-yl)prop-2-enenitrile Openeye Name: (E)-2-[4-(3-nitrophenyl)thiazol-2-yl]-3-(5-phenyl-1H-pyrazol-4-yl)prop-2-enenitrile CAS Name: (E)-2-[4-(3-nitrophenyl)-2-thiazolyl]-3-(5-phenyl-1H-pyrazol-4-yl)-2-propenenitrile IUPAC Name: (E)-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-3-(5-phenyl-1H-pyrazol-4-yl)prop-2-enenitrile Traditional Name: (E)-2-[4-(3-nitrophenyl)thiazol-2-yl]-3-(5-phenyl-1H-pyrazol-4-yl)acrylonitrile Formula: C21H13N5O2S MolecularWeight: 399.42522

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C=NN2)C=C(C#N)C3=NC(=CS3)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C=NN2)/C=C(\C#N)/C3=NC(=CS3)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H13N5O2S/c22-11-16(9-17-12-23-25-20(17)14-5-2-1-3-6-14)21-24-19(13-29-21)15-7-4-8-18(10-15)26(27)28/h1-10,12-13H,(H,23,25)/b16-9+