1-methyl-5-(4-piperidin-1-ylsulfonylphenyl)pyrrole-2-carbonitrile

Systemtic Name: 1-methyl-5-(4-piperidin-1-ylsulfonylphenyl)pyrrole-2-carbonitrile Openeye Name: 1-methyl-5-[4-(1-piperidylsulfonyl)phenyl]pyrrole-2-carbonitrile CAS Name: 1-methyl-5-[4-(1-piperidinylsulfonyl)phenyl]-2-pyrrolecarbonitrile IUPAC Name: 1-methyl-5-(4-piperidin-1-ylsulfonylphenyl)pyrrole-2-carbonitrile Traditional Name: 1-methyl-5-(4-piperidinosulfonylphenyl)pyrrole-2-carbonitrile Formula: C17H19N3O2S MolecularWeight: 329.41666

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC=C1C2=CC=C(C=C2)S(=O)(=O)N3CCCCC3)C#N

Isomeric SMILES

CN1C(=CC=C1C2=CC=C(C=C2)S(=O)(=O)N3CCCCC3)C#N

InChI

InChI=1S/C17H19N3O2S/c1-19-15(13-18)7-10-17(19)14-5-8-16(9-6-14)23(21,22)20-11-3-2-4-12-20/h5-10H,2-4,11-12H2,1H3