5-bromanyl-N-[(4-ethanoylphenyl)carbamothioyl]-2-methoxy-3-methyl-benzamide

Systemtic Name: 5-bromanyl-N-[(4-ethanoylphenyl)carbamothioyl]-2-methoxy-3-methyl-benzamide Openeye Name: N-[(4-acetylphenyl)carbamothioyl]-5-bromo-2-methoxy-3-methyl-benzamide CAS Name: N-[(4-acetylanilino)-sulfanylidenemethyl]-5-bromo-2-methoxy-3-methylbenzamide IUPAC Name: N-[(4-acetylphenyl)carbamothioyl]-5-bromo-2-methoxy-3-methylbenzamide Traditional Name: N-[(4-acetylphenyl)thiocarbamoyl]-5-bromo-2-methoxy-3-methyl-benzamide Formula: C18H17BrN2O3S MolecularWeight: 421.30818

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17BrN2O3S/c1-10-8-13(19)9-15(16(10)24-3)17(23)21-18(25)20-14-6-4-12(5-7-14)11(2)22/h4-9H,1-3H3,(H2,20,21,23,25)