2-[(4-piperidin-1-ylsulfonylphenyl)methylamino]pyridine-3-carbonitrile

Systemtic Name: 2-[(4-piperidin-1-ylsulfonylphenyl)methylamino]pyridine-3-carbonitrile Openeye Name: 2-[[4-(1-piperidylsulfonyl)phenyl]methylamino]pyridine-3-carbonitrile CAS Name: 2-[[4-(1-piperidinylsulfonyl)phenyl]methylamino]-3-pyridinecarbonitrile IUPAC Name: 2-[(4-piperidin-1-ylsulfonylphenyl)methylamino]pyridine-3-carbonitrile Traditional Name: 2-[(4-piperidinosulfonylbenzyl)amino]nicotinonitrile Formula: C18H20N4O2S MolecularWeight: 356.442

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)CNC3=C(C=CC=N3)C#N

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)CNC3=C(C=CC=N3)C#N

InChI

InChI=1S/C18H20N4O2S/c19-13-16-5-4-10-20-18(16)21-14-15-6-8-17(9-7-15)25(23,24)22-11-2-1-3-12-22/h4-10H,1-3,11-12,14H2,(H,20,21)