N,N-diethyl-9-[1-(thiophen-2-ylmethyl)piperidin-4-yl]-9H-xanthene-3-carboxamide

Systemtic Name: N,N-diethyl-9-[1-(thiophen-2-ylmethyl)piperidin-4-yl]-9H-xanthene-3-carboxamide Openeye Name: N,N-diethyl-9-[1-(2-thienylmethyl)-4-piperidyl]-9H-xanthene-3-carboxamide CAS Name: N,N-diethyl-9-[1-(thiophen-2-ylmethyl)-4-piperidinyl]-9H-xanthene-3-carboxamide IUPAC Name: N,N-diethyl-9-[1-(thiophen-2-ylmethyl)piperidin-4-yl]-9H-xanthene-3-carboxamide Traditional Name: N,N-diethyl-9-[1-(2-thenyl)-4-piperidyl]-9H-xanthene-3-carboxamide Formula: C28H32N2O2S MolecularWeight: 460.63088

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC2=C(C=C1)C(C3=CC=CC=C3O2)C4CCN(CC4)CC5=CC=CS5

Isomeric SMILES

CCN(CC)C(=O)C1=CC2=C(C=C1)C(C3=CC=CC=C3O2)C4CCN(CC4)CC5=CC=CS5

InChI

InChI=1S/C28H32N2O2S/c1-3-30(4-2)28(31)21-11-12-24-26(18-21)32-25-10-6-5-9-23(25)27(24)20-13-15-29(16-14-20)19-22-8-7-17-33-22/h5-12,17-18,20,27H,3-4,13-16,19H2,1-2H3