2,2,2-tris(chloranyl)ethyl 2-[2-(1,3-benzothiazol-2-yldisulfanyl)-4-oxidanylidene-3-(2-phenoxyethanoylamino)-3-prop-1-en-2-yl-azetidin-1-yl]ethanoate

Systemtic Name: 2,2,2-tris(chloranyl)ethyl 2-[2-(1,3-benzothiazol-2-yldisulfanyl)-4-oxidanylidene-3-(2-phenoxyethanoylamino)-3-prop-1-en-2-yl-azetidin-1-yl]ethanoate Openeye Name: 2,2,2-trichloroethyl 2-[2-(1,3-benzothiazol-2-yldisulfanyl)-3-isopropenyl-4-oxo-3-[(2-phenoxyacetyl)amino]azetidin-1-yl]acetate CAS Name: 2-[2-(1,3-benzothiazol-2-yldisulfanyl)-3-(1-methylethenyl)-4-oxo-3-[(1-oxo-2-phenoxyethyl)amino]-1-azetidinyl]acetic acid 2,2,2-trichloroethyl ester IUPAC Name: 2,2,2-trichloroethyl 2-[2-(1,3-benzothiazol-2-yldisulfanyl)-4-oxo-3-[(2-phenoxyacetyl)amino]-3-prop-1-en-2-ylazetidin-1-yl]acetate Traditional Name: 2-[2-(1,3-benzothiazol-2-yldisulfanyl)-3-isopropenyl-4-keto-3-[(2-phenoxyacetyl)amino]azetidin-1-yl]acetic acid 2,2,2-trichloroethyl ester Formula: C25H22Cl3N3O5S3 MolecularWeight: 647.01328

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C1(C(N(C1=O)CC(=O)OCC(Cl)(Cl)Cl)SSC2=NC3=CC=CC=C3S2)NC(=O)COC4=CC=CC=C4

Isomeric SMILES

CC(=C)C1(C(N(C1=O)CC(=O)OCC(Cl)(Cl)Cl)SSC2=NC3=CC=CC=C3S2)NC(=O)COC4=CC=CC=C4

InChI

InChI=1S/C25H22Cl3N3O5S3/c1-15(2)25(30-19(32)13-35-16-8-4-3-5-9-16)21(34)31(12-20(33)36-14-24(26,27)28)22(25)38-39-23-29-17-10-6-7-11-18(17)37-23/h3-11,22H,1,12-14H2,2H3,(H,30,32)