1-[4-[1-(6-methylsulfanylnaphthalen-2-yl)-1-oxidanyl-propan-2-yl]piperazin-1-yl]prop-2-en-1-one

Systemtic Name: 1-[4-[1-(6-methylsulfanylnaphthalen-2-yl)-1-oxidanyl-propan-2-yl]piperazin-1-yl]prop-2-en-1-one Openeye Name: 1-[4-[2-hydroxy-1-methyl-2-(6-methylsulfanyl-2-naphthyl)ethyl]piperazin-1-yl]prop-2-en-1-one CAS Name: 1-[4-[1-hydroxy-1-[6-(methylthio)-2-naphthalenyl]propan-2-yl]-1-piperazinyl]-2-propen-1-one IUPAC Name: 1-[4-[1-hydroxy-1-(6-methylsulfanylnaphthalen-2-yl)propan-2-yl]piperazin-1-yl]prop-2-en-1-one Traditional Name: 1-[4-[2-hydroxy-1-methyl-2-[6-(methylthio)-2-naphthyl]ethyl]piperazino]prop-2-en-1-one Formula: C21H26N2O2S MolecularWeight: 370.50834

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C1=CC2=C(C=C1)C=C(C=C2)SC)O)N3CCN(CC3)C(=O)C=C

Isomeric SMILES

CC(C(C1=CC2=C(C=C1)C=C(C=C2)SC)O)N3CCN(CC3)C(=O)C=C

InChI

InChI=1S/C21H26N2O2S/c1-4-20(24)23-11-9-22(10-12-23)15(2)21(25)18-6-5-17-14-19(26-3)8-7-16(17)13-18/h4-8,13-15,21,25H,1,9-12H2,2-3H3