(4-methoxyphenyl)methyl 2-[2-(1,3-benzothiazol-2-yldisulfanyl)-4-oxidanylidene-azetidin-1-yl]-3-methyl-but-3-enoate

Systemtic Name: (4-methoxyphenyl)methyl 2-[2-(1,3-benzothiazol-2-yldisulfanyl)-4-oxidanylidene-azetidin-1-yl]-3-methyl-but-3-enoate Openeye Name: (4-methoxyphenyl)methyl 2-[2-(1,3-benzothiazol-2-yldisulfanyl)-4-oxo-azetidin-1-yl]-3-methyl-but-3-enoate CAS Name: 2-[2-(1,3-benzothiazol-2-yldisulfanyl)-4-oxo-1-azetidinyl]-3-methyl-3-butenoic acid (4-methoxyphenyl)methyl ester IUPAC Name: (4-methoxyphenyl)methyl 2-[2-(1,3-benzothiazol-2-yldisulfanyl)-4-oxoazetidin-1-yl]-3-methylbut-3-enoate Traditional Name: 2-[2-(1,3-benzothiazol-2-yldisulfanyl)-4-keto-azetidin-1-yl]-3-methyl-but-3-enoic acid p-anisyl ester Formula: C23H22N2O4S3 MolecularWeight: 486.62678

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C(C(=O)OCC1=CC=C(C=C1)OC)N2C(CC2=O)SSC3=NC4=CC=CC=C4S3

Isomeric SMILES

CC(=C)C(C(=O)OCC1=CC=C(C=C1)OC)N2C(CC2=O)SSC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C23H22N2O4S3/c1-14(2)21(22(27)29-13-15-8-10-16(28-3)11-9-15)25-19(26)12-20(25)31-32-23-24-17-6-4-5-7-18(17)30-23/h4-11,20-21H,1,12-13H2,2-3H3