2-(1,3-benzoxazol-2-ylsulfanyl)-N-(3-nitrophenyl)propanamide

Systemtic Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-N-(3-nitrophenyl)propanamide Openeye Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-N-(3-nitrophenyl)propanamide CAS Name: 2-(1,3-benzoxazol-2-ylthio)-N-(3-nitrophenyl)propanamide IUPAC Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-N-(3-nitrophenyl)propanamide Traditional Name: 2-(1,3-benzoxazol-2-ylthio)-N-(3-nitrophenyl)propionamide Formula: C16H13N3O4S MolecularWeight: 343.35712

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=CC=C1)[N+](=O)[O-])SC2=NC3=CC=CC=C3O2

Isomeric SMILES

CC(C(=O)NC1=CC(=CC=C1)[N+](=O)[O-])SC2=NC3=CC=CC=C3O2

InChI

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