5-bromanyl-2-chloranyl-N-[[4-(diethylaminomethyl)phenyl]carbamothioyl]benzamide

Systemtic Name: 5-bromanyl-2-chloranyl-N-[[4-(diethylaminomethyl)phenyl]carbamothioyl]benzamide Openeye Name: 5-bromo-2-chloro-N-[[4-(diethylaminomethyl)phenyl]carbamothioyl]benzamide CAS Name: 5-bromo-2-chloro-N-[[4-(diethylaminomethyl)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 5-bromo-2-chloro-N-[[4-(diethylaminomethyl)phenyl]carbamothioyl]benzamide Traditional Name: 5-bromo-2-chloro-N-[[4-(diethylaminomethyl)phenyl]thiocarbamoyl]benzamide Formula: C19H21BrClN3OS MolecularWeight: 454.81154

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC1=CC=C(C=C1)NC(=S)NC(=O)C2=C(C=CC(=C2)Br)Cl

Isomeric SMILES

CCN(CC)CC1=CC=C(C=C1)NC(=S)NC(=O)C2=C(C=CC(=C2)Br)Cl

InChI

InChI=1S/C19H21BrClN3OS/c1-3-24(4-2)12-13-5-8-15(9-6-13)22-19(26)23-18(25)16-11-14(20)7-10-17(16)21/h5-11H,3-4,12H2,1-2H3,(H2,22,23,25,26)