2,4-bis[(5-ethenyl-2-methyl-3-oxidanyl-pyridin-4-yl)methyl]benzene-1,3-dicarbothioic S-acid

Systemtic Name: 2,4-bis[(5-ethenyl-2-methyl-3-oxidanyl-pyridin-4-yl)methyl]benzene-1,3-dicarbothioic S-acid Openeye Name: 2,4-bis[(3-hydroxy-2-methyl-5-vinyl-4-pyridyl)methyl]benzene-1,3-dicarbothioic S-acid CAS Name: 2,4-bis[(5-ethenyl-3-hydroxy-2-methyl-4-pyridinyl)methyl]benzene-1,3-dicarbothioic S-acid IUPAC Name: 2,4-bis[(5-ethenyl-3-hydroxy-2-methylpyridin-4-yl)methyl]benzene-1,3-dicarbothioic S-acid Traditional Name: 2,4-bis[(3-hydroxy-2-methyl-5-vinyl-4-pyridyl)methyl]benzene-1,3-dicarbothioic S-acid Formula: C26H24N2O4S2 MolecularWeight: 492.60976

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C(=C1O)CC2=C(C(=C(C=C2)C(=O)S)CC3=C(C(=NC=C3C=C)C)O)C(=O)S)C=C

Isomeric SMILES

CC1=NC=C(C(=C1O)CC2=C(C(=C(C=C2)C(=O)S)CC3=C(C(=NC=C3C=C)C)O)C(=O)S)C=C

InChI

InChI=1S/C26H24N2O4S2/c1-5-15-11-27-13(3)23(29)19(15)9-17-7-8-18(25(31)33)21(22(17)26(32)34)10-20-16(6-2)12-28-14(4)24(20)30/h5-8,11-12,29-30H,1-2,9-10H2,3-4H3,(H,31,33)(H,32,34)