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

Systemtic Name: 2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-3-oxidanylidene-3-(4-pyrrol-1-ylphenyl)propanenitrile Openeye Name: 2-[4-(3-nitrophenyl)thiazol-2-yl]-3-oxo-3-(4-pyrrol-1-ylphenyl)propanenitrile CAS Name: 2-[4-(3-nitrophenyl)-2-thiazolyl]-3-oxo-3-[4-(1-pyrrolyl)phenyl]propanenitrile IUPAC Name: 2-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-3-oxo-3-(4-pyrrol-1-ylphenyl)propanenitrile Traditional Name: 3-keto-2-[4-(3-nitrophenyl)thiazol-2-yl]-3-(4-pyrrol-1-ylphenyl)propionitrile Formula: C22H14N4O3S MolecularWeight: 414.43656

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H14N4O3S/c23-13-19(21(27)15-6-8-17(9-7-15)25-10-1-2-11-25)22-24-20(14-30-22)16-4-3-5-18(12-16)26(28)29/h1-12,14,19H