2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-3-oxidanylidene-3-thiophen-2-yl-propanenitrile

Systemtic Name: 2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-3-oxidanylidene-3-thiophen-2-yl-propanenitrile Openeye Name: 2-[4-(3-nitrophenyl)thiazol-2-yl]-3-oxo-3-(2-thienyl)propanenitrile CAS Name: 2-[4-(3-nitrophenyl)-2-thiazolyl]-3-oxo-3-thiophen-2-ylpropanenitrile IUPAC Name: 2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-3-oxo-3-thiophen-2-ylpropanenitrile Traditional Name: 3-keto-2-[4-(3-nitrophenyl)thiazol-2-yl]-3-(2-thienyl)propionitrile Formula: C16H9N3O3S2 MolecularWeight: 355.39096

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C2=CSC(=N2)C(C#N)C(=O)C3=CC=CS3

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C2=CSC(=N2)C(C#N)C(=O)C3=CC=CS3

InChI

InChI=1S/C16H9N3O3S2/c17-8-12(15(20)14-5-2-6-23-14)16-18-13(9-24-16)10-3-1-4-11(7-10)19(21)22/h1-7,9,12H