3-chloranyl-N-[(6-fluoranyl-1,3-benzothiazol-2-yl)carbamothioyl]-4-methyl-benzamide

Systemtic Name: 3-chloranyl-N-[(6-fluoranyl-1,3-benzothiazol-2-yl)carbamothioyl]-4-methyl-benzamide Openeye Name: 3-chloro-N-[(6-fluoro-1,3-benzothiazol-2-yl)carbamothioyl]-4-methyl-benzamide CAS Name: 3-chloro-N-[[(6-fluoro-1,3-benzothiazol-2-yl)amino]-sulfanylidenemethyl]-4-methylbenzamide IUPAC Name: 3-chloro-N-[(6-fluoro-1,3-benzothiazol-2-yl)carbamothioyl]-4-methylbenzamide Traditional Name: 3-chloro-N-[(6-fluoro-1,3-benzothiazol-2-yl)thiocarbamoyl]-4-methyl-benzamide Formula: C16H11ClFN3OS2 MolecularWeight: 379.859443

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC(=S)NC2=NC3=C(S2)C=C(C=C3)F)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC(=S)NC2=NC3=C(S2)C=C(C=C3)F)Cl

InChI

InChI=1S/C16H11ClFN3OS2/c1-8-2-3-9(6-11(8)17)14(22)20-15(23)21-16-19-12-5-4-10(18)7-13(12)24-16/h2-7H,1H3,(H2,19,20,21,22,23)