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

Systemtic Name: (Z)-4-bromanyl-1-(4-methoxyphenyl)-2,3-diphenyl-5-piperidin-1-yl-5-sulfanylidene-pent-2-en-1-one Openeye Name: (Z)-4-bromo-1-(4-methoxyphenyl)-2,3-diphenyl-5-(1-piperidyl)-5-thioxo-pent-2-en-1-one CAS Name: (Z)-4-bromo-1-(4-methoxyphenyl)-2,3-diphenyl-5-(1-piperidinyl)-5-sulfanylidene-2-penten-1-one IUPAC Name: (Z)-4-bromo-1-(4-methoxyphenyl)-2,3-diphenyl-5-piperidin-1-yl-5-sulfanylidenepent-2-en-1-one Traditional Name: (Z)-4-bromo-1-(4-methoxyphenyl)-2,3-diphenyl-5-piperidino-5-thioxo-pent-2-en-1-one Formula: C29H28BrNO2S MolecularWeight: 534.50712

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)C(=C(C2=CC=CC=C2)C(C(=S)N3CCCCC3)Br)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)/C(=C(/C2=CC=CC=C2)\C(C(=S)N3CCCCC3)Br)/C4=CC=CC=C4

InChI

InChI=1S/C29H28BrNO2S/c1-33-24-17-15-23(16-18-24)28(32)26(22-13-7-3-8-14-22)25(21-11-5-2-6-12-21)27(30)29(34)31-19-9-4-10-20-31/h2-3,5-8,11-18,27H,4,9-10,19-20H2,1H3/b26-25-