(Z)-1-[(4S)-4-(phenylmethyl)-2-sulfanylidene-1,3-oxazolidin-3-yl]octacos-19-en-1-one

Systemtic Name: (Z)-1-[(4S)-4-(phenylmethyl)-2-sulfanylidene-1,3-oxazolidin-3-yl]octacos-19-en-1-one Openeye Name: (Z)-1-[(4S)-4-benzyl-2-thioxo-oxazolidin-3-yl]octacos-19-en-1-one CAS Name: (Z)-1-[(4S)-4-(phenylmethyl)-2-sulfanylidene-3-oxazolidinyl]-19-octacosen-1-one IUPAC Name: (Z)-1-[(4S)-4-benzyl-2-sulfanylidene-1,3-oxazolidin-3-yl]octacos-19-en-1-one Traditional Name: (Z)-1-[(4S)-4-benzyl-2-thioxo-oxazolidin-3-yl]octacos-19-en-1-one Formula: C38H63NO2S MolecularWeight: 597.97732

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCCCCCCCCCCCC(=O)N1C(COC1=S)CC2=CC=CC=C2

Isomeric SMILES

CCCCCCCC/C=C\CCCCCCCCCCCCCCCCCC(=O)N1[C@H](COC1=S)CC2=CC=CC=C2

InChI

InChI=1S/C38H63NO2S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-29-32-37(40)39-36(34-41-38(39)42)33-35-30-27-26-28-31-35/h9-10,26-28,30-31,36H,2-8,11-25,29,32-34H2,1H3/b10-9-/t36-/m0/s1