3-bromanyl-N-[(4-phenyl-1,3-thiazol-2-yl)carbamothioyl]benzamide

Systemtic Name: 3-bromanyl-N-[(4-phenyl-1,3-thiazol-2-yl)carbamothioyl]benzamide Openeye Name: 3-bromo-N-[(4-phenylthiazol-2-yl)carbamothioyl]benzamide CAS Name: 3-bromo-N-[[(4-phenyl-2-thiazolyl)amino]-sulfanylidenemethyl]benzamide IUPAC Name: 3-bromo-N-[(4-phenyl-1,3-thiazol-2-yl)carbamothioyl]benzamide Traditional Name: 3-bromo-N-[(4-phenylthiazol-2-yl)thiocarbamoyl]benzamide Formula: C17H12BrN3OS2 MolecularWeight: 418.33068

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CSC(=N2)NC(=S)NC(=O)C3=CC(=CC=C3)Br

Isomeric SMILES

C1=CC=C(C=C1)C2=CSC(=N2)NC(=S)NC(=O)C3=CC(=CC=C3)Br

InChI

InChI=1S/C17H12BrN3OS2/c18-13-8-4-7-12(9-13)15(22)20-16(23)21-17-19-14(10-24-17)11-5-2-1-3-6-11/h1-10H,(H2,19,20,21,22,23)