N-(6-acetamido-1,3-benzothiazol-2-yl)-2-(4-chlorophenyl)sulfanyl-ethanamide

Systemtic Name: N-(6-acetamido-1,3-benzothiazol-2-yl)-2-(4-chlorophenyl)sulfanyl-ethanamide Openeye Name: N-(6-acetamido-1,3-benzothiazol-2-yl)-2-(4-chlorophenyl)sulfanyl-acetamide CAS Name: N-(6-acetamido-1,3-benzothiazol-2-yl)-2-[(4-chlorophenyl)thio]acetamide IUPAC Name: N-(6-acetamido-1,3-benzothiazol-2-yl)-2-(4-chlorophenyl)sulfanylacetamide Traditional Name: N-(6-acetamido-1,3-benzothiazol-2-yl)-2-[(4-chlorophenyl)thio]acetamide Formula: C17H14ClN3O2S2 MolecularWeight: 391.89496

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC2=C(C=C1)N=C(S2)NC(=O)CSC3=CC=C(C=C3)Cl

Isomeric SMILES

CC(=O)NC1=CC2=C(C=C1)N=C(S2)NC(=O)CSC3=CC=C(C=C3)Cl

InChI

InChI=1S/C17H14ClN3O2S2/c1-10(22)19-12-4-7-14-15(8-12)25-17(20-14)21-16(23)9-24-13-5-2-11(18)3-6-13/h2-8H,9H2,1H3,(H,19,22)(H,20,21,23)