1-[2,6-bis(chloranyl)phenyl]sulfonyl-N-(2-prop-2-enylsulfanylphenyl)piperidine-4-carboxamide

Systemtic Name: 1-[2,6-bis(chloranyl)phenyl]sulfonyl-N-(2-prop-2-enylsulfanylphenyl)piperidine-4-carboxamide Openeye Name: N-(2-allylsulfanylphenyl)-1-(2,6-dichlorophenyl)sulfonyl-piperidine-4-carboxamide CAS Name: 1-(2,6-dichlorophenyl)sulfonyl-N-[2-(prop-2-enylthio)phenyl]-4-piperidinecarboxamide IUPAC Name: 1-(2,6-dichlorophenyl)sulfonyl-N-(2-prop-2-enylsulfanylphenyl)piperidine-4-carboxamide Traditional Name: N-[2-(allylthio)phenyl]-1-(2,6-dichlorophenyl)sulfonyl-isonipecotamide Formula: C21H22Cl2N2O3S2 MolecularWeight: 485.44698

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Descriptors Computed from Structure

Canonical SMILES:

C=CCSC1=CC=CC=C1NC(=O)C2CCN(CC2)S(=O)(=O)C3=C(C=CC=C3Cl)Cl

Isomeric SMILES

C=CCSC1=CC=CC=C1NC(=O)C2CCN(CC2)S(=O)(=O)C3=C(C=CC=C3Cl)Cl

InChI

InChI=1S/C21H22Cl2N2O3S2/c1-2-14-29-19-9-4-3-8-18(19)24-21(26)15-10-12-25(13-11-15)30(27,28)20-16(22)6-5-7-17(20)23/h2-9,15H,1,10-14H2,(H,24,26)