N-[[3-bromanyl-5-(phenylcarbamoyl)phenyl]carbamothioyl]-3,4,5-trimethoxy-benzamide

Systemtic Name: N-[[3-bromanyl-5-(phenylcarbamoyl)phenyl]carbamothioyl]-3,4,5-trimethoxy-benzamide Openeye Name: N-[[3-bromo-5-(phenylcarbamoyl)phenyl]carbamothioyl]-3,4,5-trimethoxy-benzamide CAS Name: N-[[3-[anilino(oxo)methyl]-5-bromoanilino]-sulfanylidenemethyl]-3,4,5-trimethoxybenzamide IUPAC Name: N-[[3-bromo-5-(phenylcarbamoyl)phenyl]carbamothioyl]-3,4,5-trimethoxybenzamide Traditional Name: N-[[3-bromo-5-(phenylcarbamoyl)phenyl]thiocarbamoyl]-3,4,5-trimethoxy-benzamide Formula: C24H22BrN3O5S MolecularWeight: 544.41758

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)NC(=S)NC2=CC(=CC(=C2)C(=O)NC3=CC=CC=C3)Br

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)NC(=S)NC2=CC(=CC(=C2)C(=O)NC3=CC=CC=C3)Br

InChI

InChI=1S/C24H22BrN3O5S/c1-31-19-11-15(12-20(32-2)21(19)33-3)23(30)28-24(34)27-18-10-14(9-16(25)13-18)22(29)26-17-7-5-4-6-8-17/h4-13H,1-3H3,(H,26,29)(H2,27,28,30,34)