3-(4-hydroxyphenyl)-4-[9-(3-methoxypropylsulfinyl)nonyl]-3-methyl-2,4-dihydrothiochromen-7-ol

Systemtic Name: 3-(4-hydroxyphenyl)-4-[9-(3-methoxypropylsulfinyl)nonyl]-3-methyl-2,4-dihydrothiochromen-7-ol Openeye Name: 3-(4-hydroxyphenyl)-4-[9-(3-methoxypropylsulfinyl)nonyl]-3-methyl-thiochroman-7-ol CAS Name: 3-(4-hydroxyphenyl)-4-[9-(3-methoxypropylsulfinyl)nonyl]-3-methyl-2,4-dihydro-1-benzothiopyran-7-ol IUPAC Name: 3-(4-hydroxyphenyl)-4-[9-(3-methoxypropylsulfinyl)nonyl]-3-methyl-2,4-dihydrothiochromen-7-ol Traditional Name: 3-(4-hydroxyphenyl)-4-[9-(3-methoxypropylsulfinyl)nonyl]-3-methyl-thiochroman-7-ol Formula: C29H42O4S2 MolecularWeight: 518.77138

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CSC2=C(C1CCCCCCCCCS(=O)CCCOC)C=CC(=C2)O)C3=CC=C(C=C3)O

Isomeric SMILES

CC1(CSC2=C(C1CCCCCCCCCS(=O)CCCOC)C=CC(=C2)O)C3=CC=C(C=C3)O

InChI

InChI=1S/C29H42O4S2/c1-29(23-12-14-24(30)15-13-23)22-34-28-21-25(31)16-17-26(28)27(29)11-8-6-4-3-5-7-9-19-35(32)20-10-18-33-2/h12-17,21,27,30-31H,3-11,18-20,22H2,1-2H3