(E)-1-[4-[2-(3,4-dihydro-2H-thiochromen-6-yl)-2-oxidanyl-ethyl]piperazin-1-yl]-3-phenyl-prop-2-en-1-one

Systemtic Name: (E)-1-[4-[2-(3,4-dihydro-2H-thiochromen-6-yl)-2-oxidanyl-ethyl]piperazin-1-yl]-3-phenyl-prop-2-en-1-one Openeye Name: (E)-1-[4-(2-hydroxy-2-thiochroman-6-yl-ethyl)piperazin-1-yl]-3-phenyl-prop-2-en-1-one CAS Name: (E)-1-[4-[2-(3,4-dihydro-2H-1-benzothiopyran-6-yl)-2-hydroxyethyl]-1-piperazinyl]-3-phenyl-2-propen-1-one IUPAC Name: (E)-1-[4-[2-(3,4-dihydro-2H-thiochromen-6-yl)-2-hydroxyethyl]piperazin-1-yl]-3-phenylprop-2-en-1-one Traditional Name: (E)-1-[4-(2-hydroxy-2-thiochroman-6-yl-ethyl)piperazino]-3-phenyl-prop-2-en-1-one Formula: C24H28N2O2S MolecularWeight: 408.55632

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=CC(=C2)C(CN3CCN(CC3)C(=O)C=CC4=CC=CC=C4)O)SC1

Isomeric SMILES

C1CC2=C(C=CC(=C2)C(CN3CCN(CC3)C(=O)/C=C/C4=CC=CC=C4)O)SC1

InChI

InChI=1S/C24H28N2O2S/c27-22(20-9-10-23-21(17-20)7-4-16-29-23)18-25-12-14-26(15-13-25)24(28)11-8-19-5-2-1-3-6-19/h1-3,5-6,8-11,17,22,27H,4,7,12-16,18H2/b11-8+