N-(3-methylsulfanylphenyl)-1-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperidine-4-carboxamide

Systemtic Name: N-(3-methylsulfanylphenyl)-1-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperidine-4-carboxamide Openeye Name: N-(3-methylsulfanylphenyl)-1-tetralin-6-ylsulfonyl-piperidine-4-carboxamide CAS Name: N-[3-(methylthio)phenyl]-1-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)-4-piperidinecarboxamide IUPAC Name: N-(3-methylsulfanylphenyl)-1-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperidine-4-carboxamide Traditional Name: N-[3-(methylthio)phenyl]-1-tetralin-6-ylsulfonyl-isonipecotamide Formula: C23H28N2O3S2 MolecularWeight: 444.61002

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC(=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC4=C(CCCC4)C=C3

Isomeric SMILES

CSC1=CC=CC(=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC4=C(CCCC4)C=C3

InChI

InChI=1S/C23H28N2O3S2/c1-29-21-8-4-7-20(16-21)24-23(26)18-11-13-25(14-12-18)30(27,28)22-10-9-17-5-2-3-6-19(17)15-22/h4,7-10,15-16,18H,2-3,5-6,11-14H2,1H3,(H,24,26)