(phenylmethyl) 2-[(4S)-5-ethanoyl-1,1,3-tris(oxidanylidene)-4-(phenylmethyl)-1,2,5-thiadiazolidin-2-yl]ethanoate

Systemtic Name: (phenylmethyl) 2-[(4S)-5-ethanoyl-1,1,3-tris(oxidanylidene)-4-(phenylmethyl)-1,2,5-thiadiazolidin-2-yl]ethanoate Openeye Name: benzyl 2-[(4S)-5-acetyl-4-benzyl-1,1,3-trioxo-1,2,5-thiadiazolidin-2-yl]acetate CAS Name: 2-[(4S)-5-acetyl-1,1,3-trioxo-4-(phenylmethyl)-1,2,5-thiadiazolidin-2-yl]acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[(4S)-5-acetyl-4-benzyl-1,1,3-trioxo-1,2,5-thiadiazolidin-2-yl]acetate Traditional Name: 2-[(4S)-5-acetyl-4-benzyl-1,1,3-triketo-1,2,5-thiadiazolidin-2-yl]acetic acid benzyl ester Formula: C20H20N2O6S MolecularWeight: 416.4476

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C(C(=O)N(S1(=O)=O)CC(=O)OCC2=CC=CC=C2)CC3=CC=CC=C3

Isomeric SMILES

CC(=O)N1[C@H](C(=O)N(S1(=O)=O)CC(=O)OCC2=CC=CC=C2)CC3=CC=CC=C3

InChI

InChI=1S/C20H20N2O6S/c1-15(23)22-18(12-16-8-4-2-5-9-16)20(25)21(29(22,26)27)13-19(24)28-14-17-10-6-3-7-11-17/h2-11,18H,12-14H2,1H3/t18-/m0/s1