tert-butyl N-[5-(6-morpholin-4-yl-4-oxidanylidene-pyran-2-yl)-9H-thioxanthen-2-yl]carbamate

Systemtic Name: tert-butyl N-[5-(6-morpholin-4-yl-4-oxidanylidene-pyran-2-yl)-9H-thioxanthen-2-yl]carbamate Openeye Name: tert-butyl N-[5-(6-morpholino-4-oxo-pyran-2-yl)-9H-thioxanthen-2-yl]carbamate CAS Name: N-[5-[6-(4-morpholinyl)-4-oxo-2-pyranyl]-9H-thioxanthen-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[5-(6-morpholin-4-yl-4-oxopyran-2-yl)-9H-thioxanthen-2-yl]carbamate Traditional Name: N-[5-(4-keto-6-morpholino-pyran-2-yl)-9H-thioxanthen-2-yl]carbamic acid tert-butyl ester Formula: C27H28N2O5S MolecularWeight: 492.58662

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=CC2=C(C=C1)SC3=C(C=CC=C3C2)C4=CC(=O)C=C(O4)N5CCOCC5

Isomeric SMILES

CC(C)(C)OC(=O)NC1=CC2=C(C=C1)SC3=C(C=CC=C3C2)C4=CC(=O)C=C(O4)N5CCOCC5

InChI

InChI=1S/C27H28N2O5S/c1-27(2,3)34-26(31)28-19-7-8-23-18(14-19)13-17-5-4-6-21(25(17)35-23)22-15-20(30)16-24(33-22)29-9-11-32-12-10-29/h4-8,14-16H,9-13H2,1-3H3,(H,28,31)