3-(4-butylphenyl)-5-[3-(3-methoxyphenyl)sulfanylphenyl]-1-methyl-pyridine-4-thione

Systemtic Name: 3-(4-butylphenyl)-5-[3-(3-methoxyphenyl)sulfanylphenyl]-1-methyl-pyridine-4-thione Openeye Name: 3-(4-butylphenyl)-5-[3-(3-methoxyphenyl)sulfanylphenyl]-1-methyl-pyridine-4-thione CAS Name: 3-(4-butylphenyl)-5-[3-[(3-methoxyphenyl)thio]phenyl]-1-methyl-4-pyridinethione IUPAC Name: 3-(4-butylphenyl)-5-[3-(3-methoxyphenyl)sulfanylphenyl]-1-methylpyridine-4-thione Traditional Name: 3-(4-butylphenyl)-5-[3-[(3-methoxyphenyl)thio]phenyl]-1-methyl-pyridine-4-thione Formula: C29H29NOS2 MolecularWeight: 471.67666

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C2=CN(C=C(C2=S)C3=CC(=CC=C3)SC4=CC=CC(=C4)OC)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)C2=CN(C=C(C2=S)C3=CC(=CC=C3)SC4=CC=CC(=C4)OC)C

InChI

InChI=1S/C29H29NOS2/c1-4-5-8-21-13-15-22(16-14-21)27-19-30(2)20-28(29(27)32)23-9-6-11-25(17-23)33-26-12-7-10-24(18-26)31-3/h6-7,9-20H,4-5,8H2,1-3H3