3-(1-oxidanylidene-4-thiophen-2-yl-phthalazin-2-yl)propanenitrile

Systemtic Name: 3-(1-oxidanylidene-4-thiophen-2-yl-phthalazin-2-yl)propanenitrile Openeye Name: 3-[1-oxo-4-(2-thienyl)phthalazin-2-yl]propanenitrile CAS Name: 3-(1-oxo-4-thiophen-2-yl-2-phthalazinyl)propanenitrile IUPAC Name: 3-(1-oxo-4-thiophen-2-ylphthalazin-2-yl)propanenitrile Traditional Name: 3-[1-keto-4-(2-thienyl)phthalazin-2-yl]propionitrile Formula: C15H11N3OS MolecularWeight: 281.33234

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NN(C2=O)CCC#N)C3=CC=CS3

Isomeric SMILES

C1=CC=C2C(=C1)C(=NN(C2=O)CCC#N)C3=CC=CS3

InChI

InChI=1S/C15H11N3OS/c16-8-4-9-18-15(19)12-6-2-1-5-11(12)14(17-18)13-7-3-10-20-13/h1-3,5-7,10H,4,9H2