5-bromanyl-2-chloranyl-N-[(4,7-dimethyl-1,3-benzothiazol-2-yl)carbamothioyl]benzamide

Systemtic Name: 5-bromanyl-2-chloranyl-N-[(4,7-dimethyl-1,3-benzothiazol-2-yl)carbamothioyl]benzamide Openeye Name: 5-bromo-2-chloro-N-[(4,7-dimethyl-1,3-benzothiazol-2-yl)carbamothioyl]benzamide CAS Name: 5-bromo-2-chloro-N-[[(4,7-dimethyl-1,3-benzothiazol-2-yl)amino]-sulfanylidenemethyl]benzamide IUPAC Name: 5-bromo-2-chloro-N-[(4,7-dimethyl-1,3-benzothiazol-2-yl)carbamothioyl]benzamide Traditional Name: 5-bromo-2-chloro-N-[(4,7-dimethyl-1,3-benzothiazol-2-yl)thiocarbamoyl]benzamide Formula: C17H13BrClN3OS2 MolecularWeight: 454.79162

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C=C1)C)SC(=N2)NC(=S)NC(=O)C3=C(C=CC(=C3)Br)Cl

Isomeric SMILES

CC1=C2C(=C(C=C1)C)SC(=N2)NC(=S)NC(=O)C3=C(C=CC(=C3)Br)Cl

InChI

InChI=1S/C17H13BrClN3OS2/c1-8-3-4-9(2)14-13(8)20-17(25-14)22-16(24)21-15(23)11-7-10(18)5-6-12(11)19/h3-7H,1-2H3,(H2,20,21,22,23,24)