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

Systemtic Name: 3-(3-nitrophenyl)-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-3-oxidanylidene-propanenitrile Openeye Name: 3-(3-nitrophenyl)-2-[4-(3-nitrophenyl)thiazol-2-yl]-3-oxo-propanenitrile CAS Name: 3-(3-nitrophenyl)-2-[4-(3-nitrophenyl)-2-thiazolyl]-3-oxopropanenitrile IUPAC Name: 3-(3-nitrophenyl)-2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-3-oxopropanenitrile Traditional Name: 3-keto-3-(3-nitrophenyl)-2-[4-(3-nitrophenyl)thiazol-2-yl]propionitrile Formula: C18H10N4O5S MolecularWeight: 394.3608

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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(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C18H10N4O5S/c19-9-15(17(23)12-4-2-6-14(8-12)22(26)27)18-20-16(10-28-18)11-3-1-5-13(7-11)21(24)25/h1-8,10,15H