4,4,8-trimethyl-6-(4-pyridin-2-ylsulfanylbutoxy)-1H-3,1-benzoxazin-2-one

Systemtic Name: 4,4,8-trimethyl-6-(4-pyridin-2-ylsulfanylbutoxy)-1H-3,1-benzoxazin-2-one Openeye Name: 4,4,8-trimethyl-6-[4-(2-pyridylsulfanyl)butoxy]-1H-3,1-benzoxazin-2-one CAS Name: 4,4,8-trimethyl-6-[4-(2-pyridinylthio)butoxy]-1H-3,1-benzoxazin-2-one IUPAC Name: 4,4,8-trimethyl-6-(4-pyridin-2-ylsulfanylbutoxy)-1H-3,1-benzoxazin-2-one Traditional Name: 4,4,8-trimethyl-6-[4-(2-pyridylthio)butoxy]-1H-3,1-benzoxazin-2-one Formula: C20H24N2O3S MolecularWeight: 372.48116

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1)OCCCCSC3=CC=CC=N3)C(OC(=O)N2)(C)C

Isomeric SMILES

CC1=C2C(=CC(=C1)OCCCCSC3=CC=CC=N3)C(OC(=O)N2)(C)C

InChI

InChI=1S/C20H24N2O3S/c1-14-12-15(13-16-18(14)22-19(23)25-20(16,2)3)24-10-6-7-11-26-17-8-4-5-9-21-17/h4-5,8-9,12-13H,6-7,10-11H2,1-3H3,(H,22,23)