9H-fluoren-9-yl 2-[2-(1,3-benzothiazol-2-yldisulfanyl)-4-oxidanylidene-3-(2-phenylethanoylamino)azetidin-1-yl]but-3-enoate

Systemtic Name: 9H-fluoren-9-yl 2-[2-(1,3-benzothiazol-2-yldisulfanyl)-4-oxidanylidene-3-(2-phenylethanoylamino)azetidin-1-yl]but-3-enoate Openeye Name: 9H-fluoren-9-yl 2-[2-(1,3-benzothiazol-2-yldisulfanyl)-4-oxo-3-[(2-phenylacetyl)amino]azetidin-1-yl]but-3-enoate CAS Name: 2-[2-(1,3-benzothiazol-2-yldisulfanyl)-4-oxo-3-[(1-oxo-2-phenylethyl)amino]-1-azetidinyl]-3-butenoic acid 9H-fluoren-9-yl ester IUPAC Name: 9H-fluoren-9-yl 2-[2-(1,3-benzothiazol-2-yldisulfanyl)-4-oxo-3-[(2-phenylacetyl)amino]azetidin-1-yl]but-3-enoate Traditional Name: 2-[2-(1,3-benzothiazol-2-yldisulfanyl)-4-keto-3-[(2-phenylacetyl)amino]azetidin-1-yl]but-3-enoic acid 9H-fluoren-9-yl ester Formula: C35H27N3O4S3 MolecularWeight: 649.80158

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Descriptors Computed from Structure

Canonical SMILES:

C=CC(C(=O)OC1C2=CC=CC=C2C3=CC=CC=C13)N4C(C(C4=O)NC(=O)CC5=CC=CC=C5)SSC6=NC7=CC=CC=C7S6

Isomeric SMILES

C=CC(C(=O)OC1C2=CC=CC=C2C3=CC=CC=C13)N4C(C(C4=O)NC(=O)CC5=CC=CC=C5)SSC6=NC7=CC=CC=C7S6

InChI

InChI=1S/C35H27N3O4S3/c1-2-27(34(41)42-31-24-16-8-6-14-22(24)23-15-7-9-17-25(23)31)38-32(40)30(37-29(39)20-21-12-4-3-5-13-21)33(38)44-45-35-36-26-18-10-11-19-28(26)43-35/h2-19,27,30-31,33H,1,20H2,(H,37,39)