2-(4-chlorophenyl)sulfanyl-N-[4-(4-nitrophenyl)piperazin-1-yl]carbothioyl-ethanamide

Systemtic Name: 2-(4-chlorophenyl)sulfanyl-N-[4-(4-nitrophenyl)piperazin-1-yl]carbothioyl-ethanamide Openeye Name: 2-(4-chlorophenyl)sulfanyl-N-[4-(4-nitrophenyl)piperazine-1-carbothioyl]acetamide CAS Name: 2-[(4-chlorophenyl)thio]-N-[[4-(4-nitrophenyl)-1-piperazinyl]-sulfanylidenemethyl]acetamide IUPAC Name: 2-(4-chlorophenyl)sulfanyl-N-[4-(4-nitrophenyl)piperazine-1-carbothioyl]acetamide Traditional Name: 2-[(4-chlorophenyl)thio]-N-[4-(4-nitrophenyl)piperazine-1-carbothioyl]acetamide Formula: C19H19ClN4O3S2 MolecularWeight: 450.96216

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H19ClN4O3S2/c20-14-1-7-17(8-2-14)29-13-18(25)21-19(28)23-11-9-22(10-12-23)15-3-5-16(6-4-15)24(26)27/h1-8H,9-13H2,(H,21,25,28)