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

Systemtic Name: N-[4-[4-[(4,4-dicyclohexyl-2-oxidanylidene-1H-3,1-benzoxazin-6-yl)oxy]butylsulfanyl]phenyl]ethanamide Openeye Name: N-[4-[4-[(4,4-dicyclohexyl-2-oxo-1H-3,1-benzoxazin-6-yl)oxy]butylsulfanyl]phenyl]acetamide CAS Name: N-[4-[4-[(4,4-dicyclohexyl-2-oxo-1H-3,1-benzoxazin-6-yl)oxy]butylthio]phenyl]acetamide IUPAC Name: N-[4-[4-[(4,4-dicyclohexyl-2-oxo-1H-3,1-benzoxazin-6-yl)oxy]butylsulfanyl]phenyl]acetamide Traditional Name: N-[4-[4-[(4,4-dicyclohexyl-2-keto-1H-3,1-benzoxazin-6-yl)oxy]butylthio]phenyl]acetamide Formula: C32H42N2O4S MolecularWeight: 550.75188

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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(C4CCCCC4)C5CCCCC5

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)SCCCCOC2=CC3=C(C=C2)NC(=O)OC3(C4CCCCC4)C5CCCCC5

InChI

InChI=1S/C32H42N2O4S/c1-23(35)33-26-14-17-28(18-15-26)39-21-9-8-20-37-27-16-19-30-29(22-27)32(38-31(36)34-30,24-10-4-2-5-11-24)25-12-6-3-7-13-25/h14-19,22,24-25H,2-13,20-21H2,1H3,(H,33,35)(H,34,36)