3-(3-oxidanylidene-1,4-benzoxazin-4-yl)-N-[2-(phenylmethylsulfanyl)phenyl]propanamide

Systemtic Name: 3-(3-oxidanylidene-1,4-benzoxazin-4-yl)-N-[2-(phenylmethylsulfanyl)phenyl]propanamide Openeye Name: N-(2-benzylsulfanylphenyl)-3-(3-oxo-1,4-benzoxazin-4-yl)propanamide CAS Name: 3-(3-oxo-1,4-benzoxazin-4-yl)-N-[2-(phenylmethylthio)phenyl]propanamide IUPAC Name: N-(2-benzylsulfanylphenyl)-3-(3-oxo-1,4-benzoxazin-4-yl)propanamide Traditional Name: N-[2-(benzylthio)phenyl]-3-(3-keto-1,4-benzoxazin-4-yl)propionamide Formula: C24H22N2O3S MolecularWeight: 418.50808

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)N(C2=CC=CC=C2O1)CCC(=O)NC3=CC=CC=C3SCC4=CC=CC=C4

Isomeric SMILES

C1C(=O)N(C2=CC=CC=C2O1)CCC(=O)NC3=CC=CC=C3SCC4=CC=CC=C4

InChI

InChI=1S/C24H22N2O3S/c27-23(14-15-26-20-11-5-6-12-21(20)29-16-24(26)28)25-19-10-4-7-13-22(19)30-17-18-8-2-1-3-9-18/h1-13H,14-17H2,(H,25,27)