3-bromanyl-4-methyl-N-[(4-phenylazanylphenyl)carbamothioyl]benzamide

Systemtic Name: 3-bromanyl-4-methyl-N-[(4-phenylazanylphenyl)carbamothioyl]benzamide Openeye Name: N-[(4-anilinophenyl)carbamothioyl]-3-bromo-4-methyl-benzamide CAS Name: N-[(4-anilinoanilino)-sulfanylidenemethyl]-3-bromo-4-methylbenzamide IUPAC Name: N-[(4-anilinophenyl)carbamothioyl]-3-bromo-4-methylbenzamide Traditional Name: N-[(4-anilinophenyl)thiocarbamoyl]-3-bromo-4-methyl-benzamide Formula: C21H18BrN3OS MolecularWeight: 440.35612

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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)NC3=CC=CC=C3)Br

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)NC3=CC=CC=C3)Br

InChI

InChI=1S/C21H18BrN3OS/c1-14-7-8-15(13-19(14)22)20(26)25-21(27)24-18-11-9-17(10-12-18)23-16-5-3-2-4-6-16/h2-13,23H,1H3,(H2,24,25,26,27)