2-[(3-azanylpiperidin-1-yl)sulfonylmethyl]benzenecarbonitrile

Systemtic Name: 2-[(3-azanylpiperidin-1-yl)sulfonylmethyl]benzenecarbonitrile Openeye Name: 2-[(3-amino-1-piperidyl)sulfonylmethyl]benzonitrile CAS Name: 2-[(3-amino-1-piperidinyl)sulfonylmethyl]benzonitrile IUPAC Name: 2-[(3-aminopiperidin-1-yl)sulfonylmethyl]benzonitrile Traditional Name: 2-[(3-aminopiperidino)sulfonylmethyl]benzonitrile Formula: C13H17N3O2S MolecularWeight: 279.35798

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)S(=O)(=O)CC2=CC=CC=C2C#N)N

Isomeric SMILES

C1CC(CN(C1)S(=O)(=O)CC2=CC=CC=C2C#N)N

InChI

InChI=1S/C13H17N3O2S/c14-8-11-4-1-2-5-12(11)10-19(17,18)16-7-3-6-13(15)9-16/h1-2,4-5,13H,3,6-7,9-10,15H2