phenyl 2-(phenylmethyl)-2-thiophen-2-yl-3-[2,4,6-tris(oxidanylidene)-3,5-bis[3-oxidanylidene-3-phenoxy-2-(phenylmethyl)-2-thiophen-2-yl-propyl]-1,3,5-triazinan-1-yl]propanoate

Systemtic Name: phenyl 2-(phenylmethyl)-2-thiophen-2-yl-3-[2,4,6-tris(oxidanylidene)-3,5-bis[3-oxidanylidene-3-phenoxy-2-(phenylmethyl)-2-thiophen-2-yl-propyl]-1,3,5-triazinan-1-yl]propanoate Openeye Name: phenyl 2-benzyl-3-[3,5-bis[2-benzyl-3-oxo-3-phenoxy-2-(2-thienyl)propyl]-2,4,6-trioxo-1,3,5-triazinan-1-yl]-2-(2-thienyl)propanoate CAS Name: 2-(phenylmethyl)-2-thiophen-2-yl-3-[2,4,6-trioxo-3,5-bis[3-oxo-3-phenoxy-2-(phenylmethyl)-2-thiophen-2-ylpropyl]-1,3,5-triazinan-1-yl]propanoic acid phenyl ester IUPAC Name: phenyl 2-benzyl-3-[3,5-bis(2-benzyl-3-oxo-3-phenoxy-2-thiophen-2-ylpropyl)-2,4,6-trioxo-1,3,5-triazinan-1-yl]-2-thiophen-2-ylpropanoate Traditional Name: 2-benzyl-3-[3,5-bis[2-benzyl-3-keto-3-phenoxy-2-(2-thienyl)propyl]-2,4,6-triketo-1,3,5-triazinan-1-yl]-2-(2-thienyl)propionic acid phenyl ester Formula: C63H51N3O9S3 MolecularWeight: 1090.28874

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(CN2C(=O)N(C(=O)N(C2=O)CC(CC3=CC=CC=C3)(C4=CC=CS4)C(=O)OC5=CC=CC=C5)CC(CC6=CC=CC=C6)(C7=CC=CS7)C(=O)OC8=CC=CC=C8)(C9=CC=CS9)C(=O)OC1=CC=CC=C1

Isomeric SMILES

C1=CC=C(C=C1)CC(CN2C(=O)N(C(=O)N(C2=O)CC(CC3=CC=CC=C3)(C4=CC=CS4)C(=O)OC5=CC=CC=C5)CC(CC6=CC=CC=C6)(C7=CC=CS7)C(=O)OC8=CC=CC=C8)(C9=CC=CS9)C(=O)OC1=CC=CC=C1

InChI

InChI=1S/C63H51N3O9S3/c67-55(73-49-28-13-4-14-29-49)61(52-34-19-37-76-52,40-46-22-7-1-8-23-46)43-64-58(70)65(44-62(53-35-20-38-77-53,41-47-24-9-2-10-25-47)56(68)74-50-30-15-5-16-31-50)60(72)66(59(64)71)45-63(54-36-21-39-78-54,42-48-26-11-3-12-27-48)57(69)75-51-32-17-6-18-33-51/h1-39H,40-45H2