tert-butyl [2-oxidanylidene-4-(pyridin-2-ylsulfanylmethyl)chromen-7-yl] carbonate

Systemtic Name: tert-butyl [2-oxidanylidene-4-(pyridin-2-ylsulfanylmethyl)chromen-7-yl] carbonate Openeye Name: tert-butyl [2-oxo-4-(2-pyridylsulfanylmethyl)chromen-7-yl] carbonate CAS Name: carbonic acid tert-butyl [2-oxo-4-[(2-pyridinylthio)methyl]-1-benzopyran-7-yl] ester IUPAC Name: tert-butyl [2-oxo-4-(pyridin-2-ylsulfanylmethyl)chromen-7-yl] carbonate Traditional Name: carbonic acid tert-butyl [2-keto-4-[(2-pyridylthio)methyl]chromen-7-yl] ester Formula: C20H19NO5S MolecularWeight: 385.43356

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)OC1=CC2=C(C=C1)C(=CC(=O)O2)CSC3=CC=CC=N3

Isomeric SMILES

CC(C)(C)OC(=O)OC1=CC2=C(C=C1)C(=CC(=O)O2)CSC3=CC=CC=N3

InChI

InChI=1S/C20H19NO5S/c1-20(2,3)26-19(23)24-14-7-8-15-13(10-18(22)25-16(15)11-14)12-27-17-6-4-5-9-21-17/h4-11H,12H2,1-3H3