(E)-1-[4-[1-oxidanyl-1-(4-propan-2-ylsulfanylphenyl)propan-2-yl]piperazin-1-yl]-3-phenyl-prop-2-en-1-one

Systemtic Name: (E)-1-[4-[1-oxidanyl-1-(4-propan-2-ylsulfanylphenyl)propan-2-yl]piperazin-1-yl]-3-phenyl-prop-2-en-1-one Openeye Name: (E)-1-[4-[2-hydroxy-2-(4-isopropylsulfanylphenyl)-1-methyl-ethyl]piperazin-1-yl]-3-phenyl-prop-2-en-1-one CAS Name: (E)-1-[4-[1-hydroxy-1-[4-(propan-2-ylthio)phenyl]propan-2-yl]-1-piperazinyl]-3-phenyl-2-propen-1-one IUPAC Name: (E)-1-[4-[1-hydroxy-1-(4-propan-2-ylsulfanylphenyl)propan-2-yl]piperazin-1-yl]-3-phenylprop-2-en-1-one Traditional Name: (E)-1-[4-[2-hydroxy-2-[4-(isopropylthio)phenyl]-1-methyl-ethyl]piperazino]-3-phenyl-prop-2-en-1-one Formula: C25H32N2O2S MolecularWeight: 424.59878

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=CC=C(C=C1)C(C(C)N2CCN(CC2)C(=O)C=CC3=CC=CC=C3)O

Isomeric SMILES

CC(C)SC1=CC=C(C=C1)C(C(C)N2CCN(CC2)C(=O)/C=C/C3=CC=CC=C3)O

InChI

InChI=1S/C25H32N2O2S/c1-19(2)30-23-12-10-22(11-13-23)25(29)20(3)26-15-17-27(18-16-26)24(28)14-9-21-7-5-4-6-8-21/h4-14,19-20,25,29H,15-18H2,1-3H3/b14-9+