N-[4-[4-[(4,4-dimethyl-2-oxidanylidene-1H-3,1-benzoxazin-6-yl)oxy]butylsulfanyl]phenyl]ethanamide

Systemtic Name: N-[4-[4-[(4,4-dimethyl-2-oxidanylidene-1H-3,1-benzoxazin-6-yl)oxy]butylsulfanyl]phenyl]ethanamide Openeye Name: N-[4-[4-[(4,4-dimethyl-2-oxo-1H-3,1-benzoxazin-6-yl)oxy]butylsulfanyl]phenyl]acetamide CAS Name: N-[4-[4-[(4,4-dimethyl-2-oxo-1H-3,1-benzoxazin-6-yl)oxy]butylthio]phenyl]acetamide IUPAC Name: N-[4-[4-[(4,4-dimethyl-2-oxo-1H-3,1-benzoxazin-6-yl)oxy]butylsulfanyl]phenyl]acetamide Traditional Name: N-[4-[4-[(2-keto-4,4-dimethyl-1H-3,1-benzoxazin-6-yl)oxy]butylthio]phenyl]acetamide Formula: C22H26N2O4S MolecularWeight: 414.51784

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)SCCCCOC2=CC3=C(C=C2)NC(=O)OC3(C)C

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)SCCCCOC2=CC3=C(C=C2)NC(=O)OC3(C)C

InChI

InChI=1S/C22H26N2O4S/c1-15(25)23-16-6-9-18(10-7-16)29-13-5-4-12-27-17-8-11-20-19(14-17)22(2,3)28-21(26)24-20/h6-11,14H,4-5,12-13H2,1-3H3,(H,23,25)(H,24,26)