3-bromanyl-N-[[4-[ethanoyl(methyl)amino]phenyl]carbamothioyl]-4-methyl-benzamide

Systemtic Name: 3-bromanyl-N-[[4-[ethanoyl(methyl)amino]phenyl]carbamothioyl]-4-methyl-benzamide Openeye Name: N-[[4-[acetyl(methyl)amino]phenyl]carbamothioyl]-3-bromo-4-methyl-benzamide CAS Name: N-[[4-[acetyl(methyl)amino]anilino]-sulfanylidenemethyl]-3-bromo-4-methylbenzamide IUPAC Name: N-[[4-[acetyl(methyl)amino]phenyl]carbamothioyl]-3-bromo-4-methylbenzamide Traditional Name: N-[[4-[acetyl(methyl)amino]phenyl]thiocarbamoyl]-3-bromo-4-methyl-benzamide Formula: C18H18BrN3O2S MolecularWeight: 420.32342

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)N(C)C(=O)C)Br

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)N(C)C(=O)C)Br

InChI

InChI=1S/C18H18BrN3O2S/c1-11-4-5-13(10-16(11)19)17(24)21-18(25)20-14-6-8-15(9-7-14)22(3)12(2)23/h4-10H,1-3H3,(H2,20,21,24,25)