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

Systemtic Name: N-[4-[4-[(4,4-dihexyl-2-oxidanylidene-1H-3,1-benzoxazin-6-yl)oxy]butylsulfanyl]phenyl]ethanamide Openeye Name: N-[4-[4-[(4,4-dihexyl-2-oxo-1H-3,1-benzoxazin-6-yl)oxy]butylsulfanyl]phenyl]acetamide CAS Name: N-[4-[4-[(4,4-dihexyl-2-oxo-1H-3,1-benzoxazin-6-yl)oxy]butylthio]phenyl]acetamide IUPAC Name: N-[4-[4-[(4,4-dihexyl-2-oxo-1H-3,1-benzoxazin-6-yl)oxy]butylsulfanyl]phenyl]acetamide Traditional Name: N-[4-[4-[(4,4-dihexyl-2-keto-1H-3,1-benzoxazin-6-yl)oxy]butylthio]phenyl]acetamide Formula: C32H46N2O4S MolecularWeight: 554.78364

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1(C2=C(C=CC(=C2)OCCCCSC3=CC=C(C=C3)NC(=O)C)NC(=O)O1)CCCCCC

Isomeric SMILES

CCCCCCC1(C2=C(C=CC(=C2)OCCCCSC3=CC=C(C=C3)NC(=O)C)NC(=O)O1)CCCCCC

InChI

InChI=1S/C32H46N2O4S/c1-4-6-8-10-20-32(21-11-9-7-5-2)29-24-27(16-19-30(29)34-31(36)38-32)37-22-12-13-23-39-28-17-14-26(15-18-28)33-25(3)35/h14-19,24H,4-13,20-23H2,1-3H3,(H,33,35)(H,34,36)