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

Systemtic Name: 3-bromanyl-4-ethoxy-N-[(6-methyl-1,3-benzothiazol-2-yl)carbamothioyl]benzamide Openeye Name: 3-bromo-4-ethoxy-N-[(6-methyl-1,3-benzothiazol-2-yl)carbamothioyl]benzamide CAS Name: 3-bromo-4-ethoxy-N-[[(6-methyl-1,3-benzothiazol-2-yl)amino]-sulfanylidenemethyl]benzamide IUPAC Name: 3-bromo-4-ethoxy-N-[(6-methyl-1,3-benzothiazol-2-yl)carbamothioyl]benzamide Traditional Name: 3-bromo-4-ethoxy-N-[(6-methyl-1,3-benzothiazol-2-yl)thiocarbamoyl]benzamide Formula: C18H16BrN3O2S2 MolecularWeight: 450.37254

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=NC3=C(S2)C=C(C=C3)C)Br

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=NC3=C(S2)C=C(C=C3)C)Br

InChI

InChI=1S/C18H16BrN3O2S2/c1-3-24-14-7-5-11(9-12(14)19)16(23)21-17(25)22-18-20-13-6-4-10(2)8-15(13)26-18/h4-9H,3H2,1-2H3,(H2,20,21,22,23,25)