4,4-diethyl-6-(4-phenylsulfanylbutoxy)-1H-3,1-benzoxazin-2-one

Systemtic Name: 4,4-diethyl-6-(4-phenylsulfanylbutoxy)-1H-3,1-benzoxazin-2-one Openeye Name: 4,4-diethyl-6-(4-phenylsulfanylbutoxy)-1H-3,1-benzoxazin-2-one CAS Name: 4,4-diethyl-6-[4-(phenylthio)butoxy]-1H-3,1-benzoxazin-2-one IUPAC Name: 4,4-diethyl-6-(4-phenylsulfanylbutoxy)-1H-3,1-benzoxazin-2-one Traditional Name: 4,4-diethyl-6-[4-(phenylthio)butoxy]-1H-3,1-benzoxazin-2-one Formula: C22H27NO3S MolecularWeight: 385.51968

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(C2=C(C=CC(=C2)OCCCCSC3=CC=CC=C3)NC(=O)O1)CC

Isomeric SMILES

CCC1(C2=C(C=CC(=C2)OCCCCSC3=CC=CC=C3)NC(=O)O1)CC

InChI

InChI=1S/C22H27NO3S/c1-3-22(4-2)19-16-17(12-13-20(19)23-21(24)26-22)25-14-8-9-15-27-18-10-6-5-7-11-18/h5-7,10-13,16H,3-4,8-9,14-15H2,1-2H3,(H,23,24)