2-(1,3-benzoxazol-2-ylsulfanyl)-N-(2,4-dimethyl-6-nitro-phenyl)ethanamide

Systemtic Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-N-(2,4-dimethyl-6-nitro-phenyl)ethanamide Openeye Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-N-(2,4-dimethyl-6-nitro-phenyl)acetamide CAS Name: 2-(1,3-benzoxazol-2-ylthio)-N-(2,4-dimethyl-6-nitrophenyl)acetamide IUPAC Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-N-(2,4-dimethyl-6-nitrophenyl)acetamide Traditional Name: 2-(1,3-benzoxazol-2-ylthio)-N-(2,4-dimethyl-6-nitro-phenyl)acetamide Formula: C17H15N3O4S MolecularWeight: 357.3837

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)[N+](=O)[O-])NC(=O)CSC2=NC3=CC=CC=C3O2)C

Isomeric SMILES

CC1=CC(=C(C(=C1)[N+](=O)[O-])NC(=O)CSC2=NC3=CC=CC=C3O2)C

InChI

InChI=1S/C17H15N3O4S/c1-10-7-11(2)16(13(8-10)20(22)23)19-15(21)9-25-17-18-12-5-3-4-6-14(12)24-17/h3-8H,9H2,1-2H3,(H,19,21)