tert-butyl 4-[4-(2-morpholin-4-yl-4-oxidanylidene-chromen-8-yl)dibenzothiophen-1-yl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[4-(2-morpholin-4-yl-4-oxidanylidene-chromen-8-yl)dibenzothiophen-1-yl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[4-(2-morpholino-4-oxo-chromen-8-yl)dibenzothiophen-1-yl]piperazine-1-carboxylate CAS Name: 4-[4-[2-(4-morpholinyl)-4-oxo-1-benzopyran-8-yl]-1-dibenzothiophenyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-(2-morpholin-4-yl-4-oxochromen-8-yl)dibenzothiophen-1-yl]piperazine-1-carboxylate Traditional Name: 4-[4-(4-keto-2-morpholino-chromen-8-yl)dibenzothiophen-1-yl]piperazine-1-carboxylic acid tert-butyl ester Formula: C34H35N3O5S MolecularWeight: 597.7238

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C2=C3C4=CC=CC=C4SC3=C(C=C2)C5=CC=CC6=C5OC(=CC6=O)N7CCOCC7

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C2=C3C4=CC=CC=C4SC3=C(C=C2)C5=CC=CC6=C5OC(=CC6=O)N7CCOCC7

InChI

InChI=1S/C34H35N3O5S/c1-34(2,3)42-33(39)37-15-13-35(14-16-37)26-12-11-23(32-30(26)25-7-4-5-10-28(25)43-32)22-8-6-9-24-27(38)21-29(41-31(22)24)36-17-19-40-20-18-36/h4-12,21H,13-20H2,1-3H3