2-(4H-3,1-benzothiazin-2-ylsulfanyl)-N-(2-methoxy-5-nitro-phenyl)propanamide

Systemtic Name: 2-(4H-3,1-benzothiazin-2-ylsulfanyl)-N-(2-methoxy-5-nitro-phenyl)propanamide Openeye Name: 2-(4H-3,1-benzothiazin-2-ylsulfanyl)-N-(2-methoxy-5-nitro-phenyl)propanamide CAS Name: 2-(4H-3,1-benzothiazin-2-ylthio)-N-(2-methoxy-5-nitrophenyl)propanamide IUPAC Name: 2-(4H-3,1-benzothiazin-2-ylsulfanyl)-N-(2-methoxy-5-nitrophenyl)propanamide Traditional Name: 2-(4H-3,1-benzothiazin-2-ylthio)-N-(2-methoxy-5-nitro-phenyl)propionamide Formula: C18H17N3O4S2 MolecularWeight: 403.47528

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=CC(=C1)[N+](=O)[O-])OC)SC2=NC3=CC=CC=C3CS2

Isomeric SMILES

CC(C(=O)NC1=C(C=CC(=C1)[N+](=O)[O-])OC)SC2=NC3=CC=CC=C3CS2

InChI

InChI=1S/C18H17N3O4S2/c1-11(27-18-20-14-6-4-3-5-12(14)10-26-18)17(22)19-15-9-13(21(23)24)7-8-16(15)25-2/h3-9,11H,10H2,1-2H3,(H,19,22)