2-(1,3-benzoxazol-2-ylsulfanyl)-N-methyl-N-(4-nitrophenyl)ethanamide

Systemtic Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-N-methyl-N-(4-nitrophenyl)ethanamide Openeye Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-N-methyl-N-(4-nitrophenyl)acetamide CAS Name: 2-(1,3-benzoxazol-2-ylthio)-N-methyl-N-(4-nitrophenyl)acetamide IUPAC Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-N-methyl-N-(4-nitrophenyl)acetamide Traditional Name: 2-(1,3-benzoxazol-2-ylthio)-N-methyl-N-(4-nitrophenyl)acetamide Formula: C16H13N3O4S MolecularWeight: 343.35712

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H13N3O4S/c1-18(11-6-8-12(9-7-11)19(21)22)15(20)10-24-16-17-13-4-2-3-5-14(13)23-16/h2-9H,10H2,1H3