(E)-1-(4-methoxyphenyl)-2,3-diphenyl-5-piperidin-1-yl-5-sulfanylidene-pent-2-en-1-one

Systemtic Name: (E)-1-(4-methoxyphenyl)-2,3-diphenyl-5-piperidin-1-yl-5-sulfanylidene-pent-2-en-1-one Openeye Name: (E)-1-(4-methoxyphenyl)-2,3-diphenyl-5-(1-piperidyl)-5-thioxo-pent-2-en-1-one CAS Name: (E)-1-(4-methoxyphenyl)-2,3-diphenyl-5-(1-piperidinyl)-5-sulfanylidene-2-penten-1-one IUPAC Name: (E)-1-(4-methoxyphenyl)-2,3-diphenyl-5-piperidin-1-yl-5-sulfanylidenepent-2-en-1-one Traditional Name: (E)-1-(4-methoxyphenyl)-2,3-diphenyl-5-piperidino-5-thioxo-pent-2-en-1-one Formula: C29H29NO2S MolecularWeight: 455.61106

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)C(=C(CC(=S)N2CCCCC2)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)/C(=C(\CC(=S)N2CCCCC2)/C3=CC=CC=C3)/C4=CC=CC=C4

InChI

InChI=1S/C29H29NO2S/c1-32-25-17-15-24(16-18-25)29(31)28(23-13-7-3-8-14-23)26(22-11-5-2-6-12-22)21-27(33)30-19-9-4-10-20-30/h2-3,5-8,11-18H,4,9-10,19-21H2,1H3/b28-26+