3-oxidanylidene-2-(4-phenyl-1,3-thiazol-2-yl)-3-(4-pyrrol-1-ylphenyl)propanenitrile

Systemtic Name: 3-oxidanylidene-2-(4-phenyl-1,3-thiazol-2-yl)-3-(4-pyrrol-1-ylphenyl)propanenitrile Openeye Name: 3-oxo-2-(4-phenylthiazol-2-yl)-3-(4-pyrrol-1-ylphenyl)propanenitrile CAS Name: 3-oxo-2-(4-phenyl-2-thiazolyl)-3-[4-(1-pyrrolyl)phenyl]propanenitrile IUPAC Name: 3-oxo-2-(4-phenyl-1,3-thiazol-2-yl)-3-(4-pyrrol-1-ylphenyl)propanenitrile Traditional Name: 3-keto-2-(4-phenylthiazol-2-yl)-3-(4-pyrrol-1-ylphenyl)propionitrile Formula: C22H15N3OS MolecularWeight: 369.439

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CSC(=N2)C(C#N)C(=O)C3=CC=C(C=C3)N4C=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=CSC(=N2)C(C#N)C(=O)C3=CC=C(C=C3)N4C=CC=C4

InChI

InChI=1S/C22H15N3OS/c23-14-19(22-24-20(15-27-22)16-6-2-1-3-7-16)21(26)17-8-10-18(11-9-17)25-12-4-5-13-25/h1-13,15,19H