5-[2-(2-methylsulfonylphenyl)carbonylpyrazolidin-1-yl]carbonylpyridine-2-carbonitrile

Systemtic Name: 5-[2-(2-methylsulfonylphenyl)carbonylpyrazolidin-1-yl]carbonylpyridine-2-carbonitrile Openeye Name: 5-[2-(2-methylsulfonylbenzoyl)pyrazolidine-1-carbonyl]pyridine-2-carbonitrile CAS Name: 5-[[2-[(2-methylsulfonylphenyl)-oxomethyl]-1-pyrazolidinyl]-oxomethyl]-2-pyridinecarbonitrile IUPAC Name: 5-[2-(2-methylsulfonylbenzoyl)pyrazolidine-1-carbonyl]pyridine-2-carbonitrile Traditional Name: 5-[2-(2-mesylbenzoyl)pyrazolidine-1-carbonyl]picolinonitrile Formula: C18H16N4O4S MolecularWeight: 384.40904

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC=C1C(=O)N2CCCN2C(=O)C3=CN=C(C=C3)C#N

Isomeric SMILES

CS(=O)(=O)C1=CC=CC=C1C(=O)N2CCCN2C(=O)C3=CN=C(C=C3)C#N

InChI

InChI=1S/C18H16N4O4S/c1-27(25,26)16-6-3-2-5-15(16)18(24)22-10-4-9-21(22)17(23)13-7-8-14(11-19)20-12-13/h2-3,5-8,12H,4,9-10H2,1H3