N-[(6-acetamido-1,3-benzothiazol-2-yl)carbamothioyl]-2-(4-chlorophenyl)ethanamide

Systemtic Name: N-[(6-acetamido-1,3-benzothiazol-2-yl)carbamothioyl]-2-(4-chlorophenyl)ethanamide Openeye Name: N-[(6-acetamido-1,3-benzothiazol-2-yl)carbamothioyl]-2-(4-chlorophenyl)acetamide CAS Name: N-[[(6-acetamido-1,3-benzothiazol-2-yl)amino]-sulfanylidenemethyl]-2-(4-chlorophenyl)acetamide IUPAC Name: N-[(6-acetamido-1,3-benzothiazol-2-yl)carbamothioyl]-2-(4-chlorophenyl)acetamide Traditional Name: N-[(6-acetamido-1,3-benzothiazol-2-yl)thiocarbamoyl]-2-(4-chlorophenyl)acetamide Formula: C18H15ClN4O2S2 MolecularWeight: 418.9203

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC2=C(C=C1)N=C(S2)NC(=S)NC(=O)CC3=CC=C(C=C3)Cl

Isomeric SMILES

CC(=O)NC1=CC2=C(C=C1)N=C(S2)NC(=S)NC(=O)CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H15ClN4O2S2/c1-10(24)20-13-6-7-14-15(9-13)27-18(21-14)23-17(26)22-16(25)8-11-2-4-12(19)5-3-11/h2-7,9H,8H2,1H3,(H,20,24)(H2,21,22,23,25,26)