3-tert-butyl-N-[3-[4-[(6-methoxypyridin-3-yl)amino]-2-oxidanylidene-4-sulfanylidene-butyl]sulfanylphenyl]-4-oxidanyl-benzamide

Systemtic Name: 3-tert-butyl-N-[3-[4-[(6-methoxypyridin-3-yl)amino]-2-oxidanylidene-4-sulfanylidene-butyl]sulfanylphenyl]-4-oxidanyl-benzamide Openeye Name: 3-tert-butyl-4-hydroxy-N-[3-[4-[(6-methoxy-3-pyridyl)amino]-2-oxo-4-thioxo-butyl]sulfanylphenyl]benzamide CAS Name: 3-tert-butyl-4-hydroxy-N-[3-[[4-[(6-methoxy-3-pyridinyl)amino]-2-oxo-4-sulfanylidenebutyl]thio]phenyl]benzamide IUPAC Name: 3-tert-butyl-4-hydroxy-N-[3-[4-[(6-methoxypyridin-3-yl)amino]-2-oxo-4-sulfanylidenebutyl]sulfanylphenyl]benzamide Traditional Name: 3-tert-butyl-4-hydroxy-N-[3-[[2-keto-4-[(6-methoxy-3-pyridyl)amino]-4-thioxo-butyl]thio]phenyl]benzamide Formula: C27H29N3O4S2 MolecularWeight: 523.66686

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C=CC(=C1)C(=O)NC2=CC(=CC=C2)SCC(=O)CC(=S)NC3=CN=C(C=C3)OC)O

Isomeric SMILES

CC(C)(C)C1=C(C=CC(=C1)C(=O)NC2=CC(=CC=C2)SCC(=O)CC(=S)NC3=CN=C(C=C3)OC)O

InChI

InChI=1S/C27H29N3O4S2/c1-27(2,3)22-12-17(8-10-23(22)32)26(33)30-18-6-5-7-21(13-18)36-16-20(31)14-25(35)29-19-9-11-24(34-4)28-15-19/h5-13,15,32H,14,16H2,1-4H3,(H,29,35)(H,30,33)