ethyl 2-[4-[[3,6-bis(chloranyl)-1-benzothiophen-2-yl]carbonyl]piperazin-1-yl]ethanoate

Systemtic Name: ethyl 2-[4-[[3,6-bis(chloranyl)-1-benzothiophen-2-yl]carbonyl]piperazin-1-yl]ethanoate Openeye Name: ethyl 2-[4-(3,6-dichlorobenzothiophene-2-carbonyl)piperazin-1-yl]acetate CAS Name: 2-[4-[(3,6-dichloro-1-benzothiophen-2-yl)-oxomethyl]-1-piperazinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[4-(3,6-dichloro-1-benzothiophene-2-carbonyl)piperazin-1-yl]acetate Traditional Name: 2-[4-(3,6-dichlorobenzothiophene-2-carbonyl)piperazino]acetic acid ethyl ester Formula: C17H18Cl2N2O3S MolecularWeight: 401.30742

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1CCN(CC1)C(=O)C2=C(C3=C(S2)C=C(C=C3)Cl)Cl

Isomeric SMILES

CCOC(=O)CN1CCN(CC1)C(=O)C2=C(C3=C(S2)C=C(C=C3)Cl)Cl

InChI

InChI=1S/C17H18Cl2N2O3S/c1-2-24-14(22)10-20-5-7-21(8-6-20)17(23)16-15(19)12-4-3-11(18)9-13(12)25-16/h3-4,9H,2,5-8,10H2,1H3