N-[4-(2-chloranyl-4-nitro-phenyl)piperazin-1-yl]carbothioyl-2-(4-chlorophenyl)sulfanyl-ethanamide

Systemtic Name: N-[4-(2-chloranyl-4-nitro-phenyl)piperazin-1-yl]carbothioyl-2-(4-chlorophenyl)sulfanyl-ethanamide Openeye Name: N-[4-(2-chloro-4-nitro-phenyl)piperazine-1-carbothioyl]-2-(4-chlorophenyl)sulfanyl-acetamide CAS Name: N-[[4-(2-chloro-4-nitrophenyl)-1-piperazinyl]-sulfanylidenemethyl]-2-[(4-chlorophenyl)thio]acetamide IUPAC Name: N-[4-(2-chloro-4-nitrophenyl)piperazine-1-carbothioyl]-2-(4-chlorophenyl)sulfanylacetamide Traditional Name: N-[4-(2-chloro-4-nitro-phenyl)piperazine-1-carbothioyl]-2-[(4-chlorophenyl)thio]acetamide Formula: C19H18Cl2N4O3S2 MolecularWeight: 485.40722

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=C(C=C2)[N+](=O)[O-])Cl)C(=S)NC(=O)CSC3=CC=C(C=C3)Cl

Isomeric SMILES

C1CN(CCN1C2=C(C=C(C=C2)[N+](=O)[O-])Cl)C(=S)NC(=O)CSC3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H18Cl2N4O3S2/c20-13-1-4-15(5-2-13)30-12-18(26)22-19(29)24-9-7-23(8-10-24)17-6-3-14(25(27)28)11-16(17)21/h1-6,11H,7-10,12H2,(H,22,26,29)