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

Systemtic Name: N-[3-(4-oxidanylidene-3,1-benzoxazin-2-yl)phenyl]-2-(phenylmethylsulfanyl)ethanamide Openeye Name: 2-benzylsulfanyl-N-[3-(4-oxo-3,1-benzoxazin-2-yl)phenyl]acetamide CAS Name: N-[3-(4-oxo-3,1-benzoxazin-2-yl)phenyl]-2-(phenylmethylthio)acetamide IUPAC Name: 2-benzylsulfanyl-N-[3-(4-oxo-3,1-benzoxazin-2-yl)phenyl]acetamide Traditional Name: 2-(benzylthio)-N-[3-(4-keto-3,1-benzoxazin-2-yl)phenyl]acetamide Formula: C23H18N2O3S MolecularWeight: 402.46562

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H18N2O3S/c26-21(15-29-14-16-7-2-1-3-8-16)24-18-10-6-9-17(13-18)22-25-20-12-5-4-11-19(20)23(27)28-22/h1-13H,14-15H2,(H,24,26)