4-[3-[2-(1-phenylcyclopropyl)carbonylpyrazolidin-1-yl]carbonylpyridin-2-yl]sulfanylbutanenitrile

Systemtic Name: 4-[3-[2-(1-phenylcyclopropyl)carbonylpyrazolidin-1-yl]carbonylpyridin-2-yl]sulfanylbutanenitrile Openeye Name: 4-[[3-[2-(1-phenylcyclopropanecarbonyl)pyrazolidine-1-carbonyl]-2-pyridyl]sulfanyl]butanenitrile CAS Name: 4-[[3-[oxo-[2-[oxo-(1-phenylcyclopropyl)methyl]-1-pyrazolidinyl]methyl]-2-pyridinyl]thio]butanenitrile IUPAC Name: 4-[3-[2-(1-phenylcyclopropanecarbonyl)pyrazolidine-1-carbonyl]pyridin-2-yl]sulfanylbutanenitrile Traditional Name: 4-[[3-[2-(1-phenylcyclopropanecarbonyl)pyrazolidine-1-carbonyl]-2-pyridyl]thio]butyronitrile Formula: C23H24N4O2S MolecularWeight: 420.52726

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(N(C1)C(=O)C2(CC2)C3=CC=CC=C3)C(=O)C4=C(N=CC=C4)SCCCC#N

Isomeric SMILES

C1CN(N(C1)C(=O)C2(CC2)C3=CC=CC=C3)C(=O)C4=C(N=CC=C4)SCCCC#N

InChI

InChI=1S/C23H24N4O2S/c24-13-4-5-17-30-20-19(10-6-14-25-20)21(28)26-15-7-16-27(26)22(29)23(11-12-23)18-8-2-1-3-9-18/h1-3,6,8-10,14H,4-5,7,11-12,15-17H2