methyl 2-[2-(ethanimidoyldisulfanyl)-4-oxidanylidene-3-(2-phenoxyethanoylamino)-3-prop-1-en-2-yl-azetidin-1-yl]ethanoate

Systemtic Name: methyl 2-[2-(ethanimidoyldisulfanyl)-4-oxidanylidene-3-(2-phenoxyethanoylamino)-3-prop-1-en-2-yl-azetidin-1-yl]ethanoate Openeye Name: methyl 2-[2-(ethanimidoyldisulfanyl)-3-isopropenyl-4-oxo-3-[(2-phenoxyacetyl)amino]azetidin-1-yl]acetate CAS Name: 2-[2-(1-iminoethyldisulfanyl)-3-(1-methylethenyl)-4-oxo-3-[(1-oxo-2-phenoxyethyl)amino]-1-azetidinyl]acetic acid methyl ester IUPAC Name: methyl 2-[2-(ethanimidoyldisulfanyl)-4-oxo-3-[(2-phenoxyacetyl)amino]-3-prop-1-en-2-ylazetidin-1-yl]acetate Traditional Name: 2-[2-(acetimidoyldisulfanyl)-3-isopropenyl-4-keto-3-[(2-phenoxyacetyl)amino]azetidin-1-yl]acetic acid methyl ester Formula: C19H23N3O5S2 MolecularWeight: 437.53302

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C1(C(N(C1=O)CC(=O)OC)SSC(=N)C)NC(=O)COC2=CC=CC=C2

Isomeric SMILES

CC(=C)C1(C(N(C1=O)CC(=O)OC)SSC(=N)C)NC(=O)COC2=CC=CC=C2

InChI

InChI=1S/C19H23N3O5S2/c1-12(2)19(21-15(23)11-27-14-8-6-5-7-9-14)17(25)22(10-16(24)26-4)18(19)29-28-13(3)20/h5-9,18,20H,1,10-11H2,2-4H3,(H,21,23)