N-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-2-[1,1,3-tris(oxidanylidene)-1,2-benzothiazol-2-yl]propanamide

Systemtic Name: N-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-2-[1,1,3-tris(oxidanylidene)-1,2-benzothiazol-2-yl]propanamide Openeye Name: N-[4-(3-nitrophenyl)thiazol-2-yl]-2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)propanamide CAS Name: N-[4-(3-nitrophenyl)-2-thiazolyl]-2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)propanamide IUPAC Name: N-[4-(3-nitrophenyl)-1,3-thiazol-2-yl]-2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)propanamide Traditional Name: N-[4-(3-nitrophenyl)thiazol-2-yl]-2-(1,1,3-triketo-1,2-benzothiazol-2-yl)propionamide Formula: C19H14N4O6S2 MolecularWeight: 458.46766

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=NC(=CS1)C2=CC(=CC=C2)[N+](=O)[O-])N3C(=O)C4=CC=CC=C4S3(=O)=O

Isomeric SMILES

CC(C(=O)NC1=NC(=CS1)C2=CC(=CC=C2)[N+](=O)[O-])N3C(=O)C4=CC=CC=C4S3(=O)=O

InChI

InChI=1S/C19H14N4O6S2/c1-11(22-18(25)14-7-2-3-8-16(14)31(22,28)29)17(24)21-19-20-15(10-30-19)12-5-4-6-13(9-12)23(26)27/h2-11H,1H3,(H,20,21,24)