6-[[1-(4-methylphenyl)sulfonylpiperidin-4-yl]amino]pyridine-3-carbonitrile

Systemtic Name: 6-[[1-(4-methylphenyl)sulfonylpiperidin-4-yl]amino]pyridine-3-carbonitrile Openeye Name: 6-[[1-(p-tolylsulfonyl)-4-piperidyl]amino]pyridine-3-carbonitrile CAS Name: 6-[[1-(4-methylphenyl)sulfonyl-4-piperidinyl]amino]-3-pyridinecarbonitrile IUPAC Name: 6-[[1-(4-methylphenyl)sulfonylpiperidin-4-yl]amino]pyridine-3-carbonitrile Traditional Name: 6-[(1-tosyl-4-piperidyl)amino]nicotinonitrile Formula: C18H20N4O2S MolecularWeight: 356.442

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)NC3=NC=C(C=C3)C#N

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)NC3=NC=C(C=C3)C#N

InChI

InChI=1S/C18H20N4O2S/c1-14-2-5-17(6-3-14)25(23,24)22-10-8-16(9-11-22)21-18-7-4-15(12-19)13-20-18/h2-7,13,16H,8-11H2,1H3,(H,20,21)