2-bromanyl-N-[[3-chloranyl-2-(4-methylpiperazin-1-yl)phenyl]carbamothioyl]benzamide

Systemtic Name: 2-bromanyl-N-[[3-chloranyl-2-(4-methylpiperazin-1-yl)phenyl]carbamothioyl]benzamide Openeye Name: 2-bromo-N-[[3-chloro-2-(4-methylpiperazin-1-yl)phenyl]carbamothioyl]benzamide CAS Name: 2-bromo-N-[[3-chloro-2-(4-methyl-1-piperazinyl)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 2-bromo-N-[[3-chloro-2-(4-methylpiperazin-1-yl)phenyl]carbamothioyl]benzamide Traditional Name: 2-bromo-N-[[3-chloro-2-(4-methylpiperazino)phenyl]thiocarbamoyl]benzamide Formula: C19H20BrClN4OS MolecularWeight: 467.8103

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C(C=CC=C2Cl)NC(=S)NC(=O)C3=CC=CC=C3Br

Isomeric SMILES

CN1CCN(CC1)C2=C(C=CC=C2Cl)NC(=S)NC(=O)C3=CC=CC=C3Br

InChI

InChI=1S/C19H20BrClN4OS/c1-24-9-11-25(12-10-24)17-15(21)7-4-8-16(17)22-19(27)23-18(26)13-5-2-3-6-14(13)20/h2-8H,9-12H2,1H3,(H2,22,23,26,27)