2-[4-[[3,6-bis(chloranyl)-1-benzothiophen-2-yl]carbonyl]piperazin-1-yl]-N-(2-chloranylpyridin-3-yl)ethanamide

Systemtic Name: 2-[4-[[3,6-bis(chloranyl)-1-benzothiophen-2-yl]carbonyl]piperazin-1-yl]-N-(2-chloranylpyridin-3-yl)ethanamide Openeye Name: N-(2-chloro-3-pyridyl)-2-[4-(3,6-dichlorobenzothiophene-2-carbonyl)piperazin-1-yl]acetamide CAS Name: N-(2-chloro-3-pyridinyl)-2-[4-[(3,6-dichloro-1-benzothiophen-2-yl)-oxomethyl]-1-piperazinyl]acetamide IUPAC Name: N-(2-chloropyridin-3-yl)-2-[4-(3,6-dichloro-1-benzothiophene-2-carbonyl)piperazin-1-yl]acetamide Traditional Name: N-(2-chloro-3-pyridyl)-2-[4-(3,6-dichlorobenzothiophene-2-carbonyl)piperazino]acetamide Formula: C20H17Cl3N4O2S MolecularWeight: 483.79858

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC(=O)NC2=C(N=CC=C2)Cl)C(=O)C3=C(C4=C(S3)C=C(C=C4)Cl)Cl

Isomeric SMILES

C1CN(CCN1CC(=O)NC2=C(N=CC=C2)Cl)C(=O)C3=C(C4=C(S3)C=C(C=C4)Cl)Cl

InChI

InChI=1S/C20H17Cl3N4O2S/c21-12-3-4-13-15(10-12)30-18(17(13)22)20(29)27-8-6-26(7-9-27)11-16(28)25-14-2-1-5-24-19(14)23/h1-5,10H,6-9,11H2,(H,25,28)