2-(3,4-dimethoxyphenyl)sulfanyl-1-piperazin-1-yl-ethanone

Systemtic Name: 2-(3,4-dimethoxyphenyl)sulfanyl-1-piperazin-1-yl-ethanone Openeye Name: 2-(3,4-dimethoxyphenyl)sulfanyl-1-piperazin-1-yl-ethanone CAS Name: 2-[(3,4-dimethoxyphenyl)thio]-1-(1-piperazinyl)ethanone IUPAC Name: 2-(3,4-dimethoxyphenyl)sulfanyl-1-piperazin-1-ylethanone Traditional Name: 2-[(3,4-dimethoxyphenyl)thio]-1-piperazino-ethanone Formula: C14H20N2O3S MolecularWeight: 296.3852

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)SCC(=O)N2CCNCC2)OC

Isomeric SMILES

COC1=C(C=C(C=C1)SCC(=O)N2CCNCC2)OC

InChI

InChI=1S/C14H20N2O3S/c1-18-12-4-3-11(9-13(12)19-2)20-10-14(17)16-7-5-15-6-8-16/h3-4,9,15H,5-8,10H2,1-2H3