4-[4-[3-(6-methylpyridin-2-yl)prop-2-ynylidene]piperidin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 4-[4-[3-(6-methylpyridin-2-yl)prop-2-ynylidene]piperidin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 4-[[4-[3-(6-methyl-2-pyridyl)prop-2-ynylidene]-1-piperidyl]sulfonyl]benzonitrile CAS Name: 4-[[4-[3-(6-methyl-2-pyridinyl)prop-2-ynylidene]-1-piperidinyl]sulfonyl]benzonitrile IUPAC Name: 4-[4-[3-(6-methylpyridin-2-yl)prop-2-ynylidene]piperidin-1-yl]sulfonylbenzonitrile Traditional Name: 4-[4-[3-(6-methyl-2-pyridyl)prop-2-ynylidene]piperidino]sulfonylbenzonitrile Formula: C21H19N3O2S MolecularWeight: 377.45946

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=N1)C#CC=C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C#N

Isomeric SMILES

CC1=CC=CC(=N1)C#CC=C2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C21H19N3O2S/c1-17-4-2-6-20(23-17)7-3-5-18-12-14-24(15-13-18)27(25,26)21-10-8-19(16-22)9-11-21/h2,4-6,8-11H,12-15H2,1H3