N,N-diethyl-4-methoxy-3-[4-(3-methylsulfanylpropanoyl)piperazin-1-yl]benzenesulfonamide

Systemtic Name: N,N-diethyl-4-methoxy-3-[4-(3-methylsulfanylpropanoyl)piperazin-1-yl]benzenesulfonamide Openeye Name: N,N-diethyl-4-methoxy-3-[4-(3-methylsulfanylpropanoyl)piperazin-1-yl]benzenesulfonamide CAS Name: N,N-diethyl-4-methoxy-3-[4-[3-(methylthio)-1-oxopropyl]-1-piperazinyl]benzenesulfonamide IUPAC Name: N,N-diethyl-4-methoxy-3-[4-(3-methylsulfanylpropanoyl)piperazin-1-yl]benzenesulfonamide Traditional Name: N,N-diethyl-4-methoxy-3-[4-[3-(methylthio)propanoyl]piperazino]benzenesulfonamide Formula: C19H31N3O4S2 MolecularWeight: 429.59714

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)OC)N2CCN(CC2)C(=O)CCSC

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)OC)N2CCN(CC2)C(=O)CCSC

InChI

InChI=1S/C19H31N3O4S2/c1-5-22(6-2)28(24,25)16-7-8-18(26-3)17(15-16)20-10-12-21(13-11-20)19(23)9-14-27-4/h7-8,15H,5-6,9-14H2,1-4H3