6-methoxy-3-[4-(phenylmethyl)piperidin-1-yl]thiochromen-4-one

Systemtic Name: 6-methoxy-3-[4-(phenylmethyl)piperidin-1-yl]thiochromen-4-one Openeye Name: 3-(4-benzyl-1-piperidyl)-6-methoxy-thiochromen-4-one CAS Name: 6-methoxy-3-[4-(phenylmethyl)-1-piperidinyl]-1-benzothiopyran-4-one IUPAC Name: 3-(4-benzylpiperidin-1-yl)-6-methoxythiochromen-4-one Traditional Name: 3-(4-benzylpiperidino)-6-methoxy-thiochromen-4-one Formula: C22H23NO2S MolecularWeight: 365.48852

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)SC=C(C2=O)N3CCC(CC3)CC4=CC=CC=C4

Isomeric SMILES

COC1=CC2=C(C=C1)SC=C(C2=O)N3CCC(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C22H23NO2S/c1-25-18-7-8-21-19(14-18)22(24)20(15-26-21)23-11-9-17(10-12-23)13-16-5-3-2-4-6-16/h2-8,14-15,17H,9-13H2,1H3