2-[4-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-ylcarbonyl)piperidin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 2-[4-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-ylcarbonyl)piperidin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 2-[[4-(6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carbonyl)-1-piperidyl]sulfonyl]benzonitrile CAS Name: 2-[[4-[6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl(oxo)methyl]-1-piperidinyl]sulfonyl]benzonitrile IUPAC Name: 2-[4-(6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carbonyl)piperidin-1-yl]sulfonylbenzonitrile Traditional Name: 2-[4-(6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carbonyl)piperidino]sulfonylbenzonitrile Formula: C20H21N3O3S2 MolecularWeight: 415.52904

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)N2CCC3=C(C2)C=CS3)S(=O)(=O)C4=CC=CC=C4C#N

Isomeric SMILES

C1CN(CCC1C(=O)N2CCC3=C(C2)C=CS3)S(=O)(=O)C4=CC=CC=C4C#N

InChI

InChI=1S/C20H21N3O3S2/c21-13-16-3-1-2-4-19(16)28(25,26)23-10-5-15(6-11-23)20(24)22-9-7-18-17(14-22)8-12-27-18/h1-4,8,12,15H,5-7,9-11,14H2