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

Systemtic Name: (E)-1-[4-[1-(3,4-dihydro-2H-thiochromen-6-yl)-1-oxidanyl-propan-2-yl]piperazin-1-yl]-3-phenyl-prop-2-en-1-one Openeye Name: (E)-1-[4-(2-hydroxy-1-methyl-2-thiochroman-6-yl-ethyl)piperazin-1-yl]-3-phenyl-prop-2-en-1-one CAS Name: (E)-1-[4-[1-(3,4-dihydro-2H-1-benzothiopyran-6-yl)-1-hydroxypropan-2-yl]-1-piperazinyl]-3-phenyl-2-propen-1-one IUPAC Name: (E)-1-[4-[1-(3,4-dihydro-2H-thiochromen-6-yl)-1-hydroxypropan-2-yl]piperazin-1-yl]-3-phenylprop-2-en-1-one Traditional Name: (E)-1-[4-(2-hydroxy-1-methyl-2-thiochroman-6-yl-ethyl)piperazino]-3-phenyl-prop-2-en-1-one Formula: C25H30N2O2S MolecularWeight: 422.5829

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C1=CC2=C(C=C1)SCCC2)O)N3CCN(CC3)C(=O)C=CC4=CC=CC=C4

Isomeric SMILES

CC(C(C1=CC2=C(C=C1)SCCC2)O)N3CCN(CC3)C(=O)/C=C/C4=CC=CC=C4

InChI

InChI=1S/C25H30N2O2S/c1-19(25(29)22-10-11-23-21(18-22)8-5-17-30-23)26-13-15-27(16-14-26)24(28)12-9-20-6-3-2-4-7-20/h2-4,6-7,9-12,18-19,25,29H,5,8,13-17H2,1H3/b12-9+