[4-[[2,6-bis(chloranyl)phenyl]methyl]piperazin-1-yl]-(3-chloranyl-6-nitro-1-benzothiophen-2-yl)methanone

Systemtic Name: [4-[[2,6-bis(chloranyl)phenyl]methyl]piperazin-1-yl]-(3-chloranyl-6-nitro-1-benzothiophen-2-yl)methanone Openeye Name: (3-chloro-6-nitro-benzothiophen-2-yl)-[4-[(2,6-dichlorophenyl)methyl]piperazin-1-yl]methanone CAS Name: (3-chloro-6-nitro-1-benzothiophen-2-yl)-[4-[(2,6-dichlorophenyl)methyl]-1-piperazinyl]methanone IUPAC Name: (3-chloro-6-nitro-1-benzothiophen-2-yl)-[4-[(2,6-dichlorophenyl)methyl]piperazin-1-yl]methanone Traditional Name: (3-chloro-6-nitro-benzothiophen-2-yl)-[4-(2,6-dichlorobenzyl)piperazino]methanone Formula: C20H16Cl3N3O3S MolecularWeight: 484.78334

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=C(C=CC=C2Cl)Cl)C(=O)C3=C(C4=C(S3)C=C(C=C4)[N+](=O)[O-])Cl

Isomeric SMILES

C1CN(CCN1CC2=C(C=CC=C2Cl)Cl)C(=O)C3=C(C4=C(S3)C=C(C=C4)[N+](=O)[O-])Cl

InChI

InChI=1S/C20H16Cl3N3O3S/c21-15-2-1-3-16(22)14(15)11-24-6-8-25(9-7-24)20(27)19-18(23)13-5-4-12(26(28)29)10-17(13)30-19/h1-5,10H,6-9,11H2