9-(8-azabicyclo[3.2.1]octan-3-ylidene)-N,N-diethyl-5-thiophen-3-yl-xanthene-3-carboxamide

Systemtic Name: 9-(8-azabicyclo[3.2.1]octan-3-ylidene)-N,N-diethyl-5-thiophen-3-yl-xanthene-3-carboxamide Openeye Name: 9-(8-azabicyclo[3.2.1]octan-3-ylidene)-N,N-diethyl-5-(3-thienyl)xanthene-3-carboxamide CAS Name: 9-(8-azabicyclo[3.2.1]octan-3-ylidene)-N,N-diethyl-5-(3-thiophenyl)-3-xanthenecarboxamide IUPAC Name: 9-(8-azabicyclo[3.2.1]octan-3-ylidene)-N,N-diethyl-5-thiophen-3-ylxanthene-3-carboxamide Traditional Name: 9-(8-azabicyclo[3.2.1]octan-3-ylidene)-N,N-diethyl-5-(3-thienyl)xanthene-3-carboxamide Formula: C29H30N2O2S MolecularWeight: 470.6257

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC2=C(C=C1)C(=C3CC4CCC(C3)N4)C5=CC=CC(=C5O2)C6=CSC=C6

Isomeric SMILES

CCN(CC)C(=O)C1=CC2=C(C=C1)C(=C3CC4CCC(C3)N4)C5=CC=CC(=C5O2)C6=CSC=C6

InChI

InChI=1S/C29H30N2O2S/c1-3-31(4-2)29(32)18-8-11-24-26(16-18)33-28-23(19-12-13-34-17-19)6-5-7-25(28)27(24)20-14-21-9-10-22(15-20)30-21/h5-8,11-13,16-17,21-22,30H,3-4,9-10,14-15H2,1-2H3