[1-[[2-azanyl-3-[4-(2-tert-butylphenyl)sulfonylphenyl]propanoyl]amino]-4-oxidanylidene-azetidin-2-yl] ethanoate

Systemtic Name: [1-[[2-azanyl-3-[4-(2-tert-butylphenyl)sulfonylphenyl]propanoyl]amino]-4-oxidanylidene-azetidin-2-yl] ethanoate Openeye Name: [1-[[2-amino-3-[4-(2-tert-butylphenyl)sulfonylphenyl]propanoyl]amino]-4-oxo-azetidin-2-yl] acetate CAS Name: acetic acid [1-[[2-amino-3-[4-(2-tert-butylphenyl)sulfonylphenyl]-1-oxopropyl]amino]-4-oxo-2-azetidinyl] ester IUPAC Name: [1-[[2-amino-3-[4-(2-tert-butylphenyl)sulfonylphenyl]propanoyl]amino]-4-oxoazetidin-2-yl] acetate Traditional Name: acetic acid [1-[[2-amino-3-[4-(2-tert-butylphenyl)sulfonylphenyl]propanoyl]amino]-4-keto-azetidin-2-yl] ester Formula: C24H29N3O6S MolecularWeight: 487.56856

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1CC(=O)N1NC(=O)C(CC2=CC=C(C=C2)S(=O)(=O)C3=CC=CC=C3C(C)(C)C)N

Isomeric SMILES

CC(=O)OC1CC(=O)N1NC(=O)C(CC2=CC=C(C=C2)S(=O)(=O)C3=CC=CC=C3C(C)(C)C)N

InChI

InChI=1S/C24H29N3O6S/c1-15(28)33-22-14-21(29)27(22)26-23(30)19(25)13-16-9-11-17(12-10-16)34(31,32)20-8-6-5-7-18(20)24(2,3)4/h5-12,19,22H,13-14,25H2,1-4H3,(H,26,30)