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

Systemtic Name: 2-(4-methylphenyl)sulfanyl-N-[3-(4-oxidanylidene-3,1-benzoxazin-2-yl)phenyl]ethanamide Openeye Name: N-[3-(4-oxo-3,1-benzoxazin-2-yl)phenyl]-2-(p-tolylsulfanyl)acetamide CAS Name: 2-[(4-methylphenyl)thio]-N-[3-(4-oxo-3,1-benzoxazin-2-yl)phenyl]acetamide IUPAC Name: 2-(4-methylphenyl)sulfanyl-N-[3-(4-oxo-3,1-benzoxazin-2-yl)phenyl]acetamide Traditional Name: N-[3-(4-keto-3,1-benzoxazin-2-yl)phenyl]-2-(p-tolylthio)acetamide Formula: C23H18N2O3S MolecularWeight: 402.46562

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCC(=O)NC2=CC=CC(=C2)C3=NC4=CC=CC=C4C(=O)O3

Isomeric SMILES

CC1=CC=C(C=C1)SCC(=O)NC2=CC=CC(=C2)C3=NC4=CC=CC=C4C(=O)O3

InChI

InChI=1S/C23H18N2O3S/c1-15-9-11-18(12-10-15)29-14-21(26)24-17-6-4-5-16(13-17)22-25-20-8-3-2-7-19(20)23(27)28-22/h2-13H,14H2,1H3,(H,24,26)