5-(2-fluoranyl-4-pyrrolidin-1-ylsulfonyl-phenyl)-1-methyl-pyrrole-2-carbonitrile

Systemtic Name: 5-(2-fluoranyl-4-pyrrolidin-1-ylsulfonyl-phenyl)-1-methyl-pyrrole-2-carbonitrile Openeye Name: 5-(2-fluoro-4-pyrrolidin-1-ylsulfonyl-phenyl)-1-methyl-pyrrole-2-carbonitrile CAS Name: 5-[2-fluoro-4-(1-pyrrolidinylsulfonyl)phenyl]-1-methyl-2-pyrrolecarbonitrile IUPAC Name: 5-(2-fluoro-4-pyrrolidin-1-ylsulfonylphenyl)-1-methylpyrrole-2-carbonitrile Traditional Name: 5-(2-fluoro-4-pyrrolidinosulfonyl-phenyl)-1-methyl-pyrrole-2-carbonitrile Formula: C16H16FN3O2S MolecularWeight: 333.380543

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC=C1C2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)F)C#N

Isomeric SMILES

CN1C(=CC=C1C2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)F)C#N

InChI

InChI=1S/C16H16FN3O2S/c1-19-12(11-18)4-7-16(19)14-6-5-13(10-15(14)17)23(21,22)20-8-2-3-9-20/h4-7,10H,2-3,8-9H2,1H3