(2-sulfanylidenepyridin-1-yl) 2-methyl-7,7-diphenyl-hept-6-enoate

Systemtic Name: (2-sulfanylidenepyridin-1-yl) 2-methyl-7,7-diphenyl-hept-6-enoate Openeye Name: (2-thioxo-1-pyridyl) 2-methyl-7,7-diphenyl-hept-6-enoate CAS Name: 2-methyl-7,7-diphenyl-6-heptenoic acid (2-sulfanylidene-1-pyridinyl) ester IUPAC Name: (2-sulfanylidenepyridin-1-yl) 2-methyl-7,7-diphenylhept-6-enoate Traditional Name: 2-methyl-7,7-diphenyl-hept-6-enoic acid (2-thioxo-1-pyridyl) ester Formula: C25H25NO2S MolecularWeight: 403.5365

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCC=C(C1=CC=CC=C1)C2=CC=CC=C2)C(=O)ON3C=CC=CC3=S

Isomeric SMILES

CC(CCCC=C(C1=CC=CC=C1)C2=CC=CC=C2)C(=O)ON3C=CC=CC3=S

InChI

InChI=1S/C25H25NO2S/c1-20(25(27)28-26-19-11-10-18-24(26)29)12-8-9-17-23(21-13-4-2-5-14-21)22-15-6-3-7-16-22/h2-7,10-11,13-20H,8-9,12H2,1H3