2-[(5-chloranyl-1,3-benzothiazol-2-yl)sulfanyl]-N-(3,4-dimethoxyphenyl)ethanamide

Systemtic Name: 2-[(5-chloranyl-1,3-benzothiazol-2-yl)sulfanyl]-N-(3,4-dimethoxyphenyl)ethanamide Openeye Name: 2-[(5-chloro-1,3-benzothiazol-2-yl)sulfanyl]-N-(3,4-dimethoxyphenyl)acetamide CAS Name: 2-[(5-chloro-1,3-benzothiazol-2-yl)thio]-N-(3,4-dimethoxyphenyl)acetamide IUPAC Name: 2-[(5-chloro-1,3-benzothiazol-2-yl)sulfanyl]-N-(3,4-dimethoxyphenyl)acetamide Traditional Name: 2-[(5-chloro-1,3-benzothiazol-2-yl)thio]-N-(3,4-dimethoxyphenyl)acetamide Formula: C17H15ClN2O3S2 MolecularWeight: 394.8956

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)CSC2=NC3=C(S2)C=CC(=C3)Cl)OC

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)CSC2=NC3=C(S2)C=CC(=C3)Cl)OC

InChI

InChI=1S/C17H15ClN2O3S2/c1-22-13-5-4-11(8-14(13)23-2)19-16(21)9-24-17-20-12-7-10(18)3-6-15(12)25-17/h3-8H,9H2,1-2H3,(H,19,21)