5-bromanyl-2-chloranyl-N-[[3-chloranyl-4-[4-[(2-chlorophenyl)methyl]piperazin-1-yl]phenyl]carbamothioyl]benzamide

Systemtic Name: 5-bromanyl-2-chloranyl-N-[[3-chloranyl-4-[4-[(2-chlorophenyl)methyl]piperazin-1-yl]phenyl]carbamothioyl]benzamide Openeye Name: 5-bromo-2-chloro-N-[[3-chloro-4-[4-[(2-chlorophenyl)methyl]piperazin-1-yl]phenyl]carbamothioyl]benzamide CAS Name: 5-bromo-2-chloro-N-[[3-chloro-4-[4-[(2-chlorophenyl)methyl]-1-piperazinyl]anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 5-bromo-2-chloro-N-[[3-chloro-4-[4-[(2-chlorophenyl)methyl]piperazin-1-yl]phenyl]carbamothioyl]benzamide Traditional Name: 5-bromo-2-chloro-N-[[3-chloro-4-[4-(2-chlorobenzyl)piperazino]phenyl]thiocarbamoyl]benzamide Formula: C25H22BrCl3N4OS MolecularWeight: 612.79638

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2Cl)C3=C(C=C(C=C3)NC(=S)NC(=O)C4=C(C=CC(=C4)Br)Cl)Cl

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2Cl)C3=C(C=C(C=C3)NC(=S)NC(=O)C4=C(C=CC(=C4)Br)Cl)Cl

InChI

InChI=1S/C25H22BrCl3N4OS/c26-17-5-7-21(28)19(13-17)24(34)31-25(35)30-18-6-8-23(22(29)14-18)33-11-9-32(10-12-33)15-16-3-1-2-4-20(16)27/h1-8,13-14H,9-12,15H2,(H2,30,31,34,35)