N-[(2-bromanyl-4-methyl-phenyl)carbamothioyl]-4-phenoxy-benzamide

Systemtic Name: N-[(2-bromanyl-4-methyl-phenyl)carbamothioyl]-4-phenoxy-benzamide Openeye Name: N-[(2-bromo-4-methyl-phenyl)carbamothioyl]-4-phenoxy-benzamide CAS Name: N-[(2-bromo-4-methylanilino)-sulfanylidenemethyl]-4-phenoxybenzamide IUPAC Name: N-[(2-bromo-4-methylphenyl)carbamothioyl]-4-phenoxybenzamide Traditional Name: N-[(2-bromo-4-methyl-phenyl)thiocarbamoyl]-4-phenoxy-benzamide Formula: C21H17BrN2O2S MolecularWeight: 441.34088

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=S)NC(=O)C2=CC=C(C=C2)OC3=CC=CC=C3)Br

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=S)NC(=O)C2=CC=C(C=C2)OC3=CC=CC=C3)Br

InChI

InChI=1S/C21H17BrN2O2S/c1-14-7-12-19(18(22)13-14)23-21(27)24-20(25)15-8-10-17(11-9-15)26-16-5-3-2-4-6-16/h2-13H,1H3,(H2,23,24,25,27)