2-(1,3-benzothiazol-2-ylsulfanyl)-N-(2-methoxy-5-nitro-phenyl)ethanamide

Systemtic Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-(2-methoxy-5-nitro-phenyl)ethanamide Openeye Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-(2-methoxy-5-nitro-phenyl)acetamide CAS Name: 2-(1,3-benzothiazol-2-ylthio)-N-(2-methoxy-5-nitrophenyl)acetamide IUPAC Name: 2-(1,3-benzothiazol-2-ylsulfanyl)-N-(2-methoxy-5-nitrophenyl)acetamide Traditional Name: 2-(1,3-benzothiazol-2-ylthio)-N-(2-methoxy-5-nitro-phenyl)acetamide Formula: C16H13N3O4S2 MolecularWeight: 375.42212

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)CSC2=NC3=CC=CC=C3S2

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])NC(=O)CSC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C16H13N3O4S2/c1-23-13-7-6-10(19(21)22)8-12(13)17-15(20)9-24-16-18-11-4-2-3-5-14(11)25-16/h2-8H,9H2,1H3,(H,17,20)