N-[(6-acetamido-1,3-benzothiazol-2-yl)carbamothioyl]-2-(2-methylphenoxy)ethanamide

Systemtic Name: N-[(6-acetamido-1,3-benzothiazol-2-yl)carbamothioyl]-2-(2-methylphenoxy)ethanamide Openeye Name: N-[(6-acetamido-1,3-benzothiazol-2-yl)carbamothioyl]-2-(2-methylphenoxy)acetamide CAS Name: N-[[(6-acetamido-1,3-benzothiazol-2-yl)amino]-sulfanylidenemethyl]-2-(2-methylphenoxy)acetamide IUPAC Name: N-[(6-acetamido-1,3-benzothiazol-2-yl)carbamothioyl]-2-(2-methylphenoxy)acetamide Traditional Name: N-[(6-acetamido-1,3-benzothiazol-2-yl)thiocarbamoyl]-2-(2-methylphenoxy)acetamide Formula: C19H18N4O3S2 MolecularWeight: 414.50122

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCC(=O)NC(=S)NC2=NC3=C(S2)C=C(C=C3)NC(=O)C

Isomeric SMILES

CC1=CC=CC=C1OCC(=O)NC(=S)NC2=NC3=C(S2)C=C(C=C3)NC(=O)C

InChI

InChI=1S/C19H18N4O3S2/c1-11-5-3-4-6-15(11)26-10-17(25)22-18(27)23-19-21-14-8-7-13(20-12(2)24)9-16(14)28-19/h3-9H,10H2,1-2H3,(H,20,24)(H2,21,22,23,25,27)