2-(3,4-dimethoxyphenyl)-1-[4-(2-oxidanylidene-2-thiophen-2-yl-ethyl)piperazin-1-yl]ethanone

Systemtic Name: 2-(3,4-dimethoxyphenyl)-1-[4-(2-oxidanylidene-2-thiophen-2-yl-ethyl)piperazin-1-yl]ethanone Openeye Name: 2-(3,4-dimethoxyphenyl)-1-[4-[2-oxo-2-(2-thienyl)ethyl]piperazin-1-yl]ethanone CAS Name: 2-(3,4-dimethoxyphenyl)-1-[4-(2-oxo-2-thiophen-2-ylethyl)-1-piperazinyl]ethanone IUPAC Name: 2-(3,4-dimethoxyphenyl)-1-[4-(2-oxo-2-thiophen-2-ylethyl)piperazin-1-yl]ethanone Traditional Name: 2-(3,4-dimethoxyphenyl)-1-[4-[2-keto-2-(2-thienyl)ethyl]piperazino]ethanone Formula: C20H24N2O4S MolecularWeight: 388.48056

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC(=O)N2CCN(CC2)CC(=O)C3=CC=CS3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CC(=O)N2CCN(CC2)CC(=O)C3=CC=CS3)OC

InChI

InChI=1S/C20H24N2O4S/c1-25-17-6-5-15(12-18(17)26-2)13-20(24)22-9-7-21(8-10-22)14-16(23)19-4-3-11-27-19/h3-6,11-12H,7-10,13-14H2,1-2H3