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

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

Systemtic Name:6-[4-(3,4-dimethylphenyl)sulfanylbutoxy]-4,4,8-trimethyl-1H-3,1-benzoxazin-2-one
Openeye Name:6-[4-(3,4-dimethylphenyl)sulfanylbutoxy]-4,4,8-trimethyl-1H-3,1-benzoxazin-2-one
CAS Name:6-[4-[(3,4-dimethylphenyl)thio]butoxy]-4,4,8-trimethyl-1H-3,1-benzoxazin-2-one
IUPAC Name:6-[4-(3,4-dimethylphenyl)sulfanylbutoxy]-4,4,8-trimethyl-1H-3,1-benzoxazin-2-one
Traditional Name:6-[4-[(3,4-dimethylphenyl)thio]butoxy]-4,4,8-trimethyl-1H-3,1-benzoxazin-2-one
Formula: C23H29NO3S
MolecularWeight: 399.54626
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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)SCCCCOC2=CC(=C3C(=C2)C(OC(=O)N3)(C)C)C)C


Isomeric SMILES

CC1=C(C=C(C=C1)SCCCCOC2=CC(=C3C(=C2)C(OC(=O)N3)(C)C)C)C


InChI

InChI=1S/C23H29NO3S/c1-15-8-9-19(13-16(15)2)28-11-7-6-10-26-18-12-17(3)21-20(14-18)23(4,5)27-22(25)24-21/h8-9,12-14H,6-7,10-11H2,1-5H3,(H,24,25)


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