(E)-1-[4-[1-(3,4-dihydro-2H-thiochromen-6-yl)-1-oxidanyl-butan-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-butan-2-yl]piperazin-1-yl]-3-phenyl-prop-2-en-1-one Openeye Name: (E)-1-[4-[1-[hydroxy(thiochroman-6-yl)methyl]propyl]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-hydroxybutan-2-yl]-1-piperazinyl]-3-phenyl-2-propen-1-one IUPAC Name: (E)-1-[4-[1-(3,4-dihydro-2H-thiochromen-6-yl)-1-hydroxybutan-2-yl]piperazin-1-yl]-3-phenylprop-2-en-1-one Traditional Name: (E)-1-[4-[1-[hydroxy(thiochroman-6-yl)methyl]propyl]piperazino]-3-phenyl-prop-2-en-1-one Formula: C26H32N2O2S MolecularWeight: 436.60948

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H32N2O2S/c1-2-23(26(30)22-11-12-24-21(19-22)9-6-18-31-24)27-14-16-28(17-15-27)25(29)13-10-20-7-4-3-5-8-20/h3-5,7-8,10-13,19,23,26,30H,2,6,9,14-18H2,1H3/b13-10+