6-[4-(4-chlorophenyl)sulfanylbutoxy]-4,4,8-trimethyl-1H-3,1-benzoxazin-2-one

Systemtic Name: 6-[4-(4-chlorophenyl)sulfanylbutoxy]-4,4,8-trimethyl-1H-3,1-benzoxazin-2-one Openeye Name: 6-[4-(4-chlorophenyl)sulfanylbutoxy]-4,4,8-trimethyl-1H-3,1-benzoxazin-2-one CAS Name: 6-[4-[(4-chlorophenyl)thio]butoxy]-4,4,8-trimethyl-1H-3,1-benzoxazin-2-one IUPAC Name: 6-[4-(4-chlorophenyl)sulfanylbutoxy]-4,4,8-trimethyl-1H-3,1-benzoxazin-2-one Traditional Name: 6-[4-[(4-chlorophenyl)thio]butoxy]-4,4,8-trimethyl-1H-3,1-benzoxazin-2-one Formula: C21H24ClNO3S MolecularWeight: 405.93816

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1)OCCCCSC3=CC=C(C=C3)Cl)C(OC(=O)N2)(C)C

Isomeric SMILES

CC1=C2C(=CC(=C1)OCCCCSC3=CC=C(C=C3)Cl)C(OC(=O)N2)(C)C

InChI

InChI=1S/C21H24ClNO3S/c1-14-12-16(13-18-19(14)23-20(24)26-21(18,2)3)25-10-4-5-11-27-17-8-6-15(22)7-9-17/h6-9,12-13H,4-5,10-11H2,1-3H3,(H,23,24)