4-[(3-chloranyl-6-nitro-1-benzothiophen-2-yl)carbonyl]-N-naphthalen-1-yl-piperazine-1-carbothioamide

Systemtic Name: 4-[(3-chloranyl-6-nitro-1-benzothiophen-2-yl)carbonyl]-N-naphthalen-1-yl-piperazine-1-carbothioamide Openeye Name: 4-(3-chloro-6-nitro-benzothiophene-2-carbonyl)-N-(1-naphthyl)piperazine-1-carbothioamide CAS Name: 4-[(3-chloro-6-nitro-1-benzothiophen-2-yl)-oxomethyl]-N-(1-naphthalenyl)-1-piperazinecarbothioamide IUPAC Name: 4-(3-chloro-6-nitro-1-benzothiophene-2-carbonyl)-N-naphthalen-1-ylpiperazine-1-carbothioamide Traditional Name: 4-(3-chloro-6-nitro-benzothiophene-2-carbonyl)-N-(1-naphthyl)piperazine-1-carbothioamide Formula: C24H19ClN4O3S2 MolecularWeight: 511.01566

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=C(C3=C(S2)C=C(C=C3)[N+](=O)[O-])Cl)C(=S)NC4=CC=CC5=CC=CC=C54

Isomeric SMILES

C1CN(CCN1C(=O)C2=C(C3=C(S2)C=C(C=C3)[N+](=O)[O-])Cl)C(=S)NC4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C24H19ClN4O3S2/c25-21-18-9-8-16(29(31)32)14-20(18)34-22(21)23(30)27-10-12-28(13-11-27)24(33)26-19-7-3-5-15-4-1-2-6-17(15)19/h1-9,14H,10-13H2,(H,26,33)