2-[(4-nitrophenyl)methylsulfanyl]-N-[3-(4-oxidanylidene-3,1-benzoxazin-2-yl)phenyl]ethanamide

Systemtic Name: 2-[(4-nitrophenyl)methylsulfanyl]-N-[3-(4-oxidanylidene-3,1-benzoxazin-2-yl)phenyl]ethanamide Openeye Name: 2-[(4-nitrophenyl)methylsulfanyl]-N-[3-(4-oxo-3,1-benzoxazin-2-yl)phenyl]acetamide CAS Name: 2-[(4-nitrophenyl)methylthio]-N-[3-(4-oxo-3,1-benzoxazin-2-yl)phenyl]acetamide IUPAC Name: 2-[(4-nitrophenyl)methylsulfanyl]-N-[3-(4-oxo-3,1-benzoxazin-2-yl)phenyl]acetamide Traditional Name: N-[3-(4-keto-3,1-benzoxazin-2-yl)phenyl]-2-[(4-nitrobenzyl)thio]acetamide Formula: C23H17N3O5S MolecularWeight: 447.46318

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)OC(=N2)C3=CC(=CC=C3)NC(=O)CSCC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)OC(=N2)C3=CC(=CC=C3)NC(=O)CSCC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H17N3O5S/c27-21(14-32-13-15-8-10-18(11-9-15)26(29)30)24-17-5-3-4-16(12-17)22-25-20-7-2-1-6-19(20)23(28)31-22/h1-12H,13-14H2,(H,24,27)