2-(1,3-benzoxazol-2-ylsulfanyl)-N-(2-methyl-3-nitro-phenyl)propanamide

Systemtic Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-N-(2-methyl-3-nitro-phenyl)propanamide Openeye Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-N-(2-methyl-3-nitro-phenyl)propanamide CAS Name: 2-(1,3-benzoxazol-2-ylthio)-N-(2-methyl-3-nitrophenyl)propanamide IUPAC Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-N-(2-methyl-3-nitrophenyl)propanamide Traditional Name: 2-(1,3-benzoxazol-2-ylthio)-N-(2-methyl-3-nitro-phenyl)propionamide Formula: C17H15N3O4S MolecularWeight: 357.3837

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])NC(=O)C(C)SC2=NC3=CC=CC=C3O2

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])NC(=O)C(C)SC2=NC3=CC=CC=C3O2

InChI

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