3-[4-oxidanylidene-3-(thiophen-2-ylmethyl)-5,6-dihydrocyclopenta[c]pyrazol-1-yl]propanenitrile

Systemtic Name: 3-[4-oxidanylidene-3-(thiophen-2-ylmethyl)-5,6-dihydrocyclopenta[c]pyrazol-1-yl]propanenitrile Openeye Name: 3-[4-oxo-3-(2-thienylmethyl)-5,6-dihydrocyclopenta[c]pyrazol-1-yl]propanenitrile CAS Name: 3-[4-oxo-3-(thiophen-2-ylmethyl)-5,6-dihydrocyclopenta[c]pyrazol-1-yl]propanenitrile IUPAC Name: 3-[4-oxo-3-(thiophen-2-ylmethyl)-5,6-dihydrocyclopenta[c]pyrazol-1-yl]propanenitrile Traditional Name: 3-[4-keto-3-(2-thenyl)-5,6-dihydrocyclopenta[c]pyrazol-1-yl]propionitrile Formula: C14H13N3OS MolecularWeight: 271.33752

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)C2=C1N(N=C2CC3=CC=CS3)CCC#N

Isomeric SMILES

C1CC(=O)C2=C1N(N=C2CC3=CC=CS3)CCC#N

InChI

InChI=1S/C14H13N3OS/c15-6-2-7-17-12-4-5-13(18)14(12)11(16-17)9-10-3-1-8-19-10/h1,3,8H,2,4-5,7,9H2