tert-butyl 2-azanyl-5-[[1,3-bis(oxidanylidene)isoindol-2-yl]methyl]-5,7-dihydro-4H-thieno[2,3-c]pyran-3-carboxylate

Systemtic Name: tert-butyl 2-azanyl-5-[[1,3-bis(oxidanylidene)isoindol-2-yl]methyl]-5,7-dihydro-4H-thieno[2,3-c]pyran-3-carboxylate Openeye Name: tert-butyl 2-amino-5-[(1,3-dioxoisoindolin-2-yl)methyl]-5,7-dihydro-4H-thieno[2,3-c]pyran-3-carboxylate CAS Name: 2-amino-5-[(1,3-dioxo-2-isoindolyl)methyl]-5,7-dihydro-4H-thieno[2,3-c]pyran-3-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-amino-5-[(1,3-dioxoisoindol-2-yl)methyl]-5,7-dihydro-4H-thieno[2,3-c]pyran-3-carboxylate Traditional Name: 2-amino-5-(phthalimidomethyl)-5,7-dihydro-4H-thieno[2,3-c]pyran-3-carboxylic acid tert-butyl ester Formula: C21H22N2O5S MolecularWeight: 414.47478

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=C(SC2=C1CC(OC2)CN3C(=O)C4=CC=CC=C4C3=O)N

Isomeric SMILES

CC(C)(C)OC(=O)C1=C(SC2=C1CC(OC2)CN3C(=O)C4=CC=CC=C4C3=O)N

InChI

InChI=1S/C21H22N2O5S/c1-21(2,3)28-20(26)16-14-8-11(27-10-15(14)29-17(16)22)9-23-18(24)12-6-4-5-7-13(12)19(23)25/h4-7,11H,8-10,22H2,1-3H3