tert-butyl 2-[2-(3-ethoxy-3-oxidanylidene-propyl)sulfanyl-3-[2-(2-ethylphenyl)ethanoylamino]-4-oxidanylidene-azetidin-1-yl]-3-methyl-but-2-enoate

Systemtic Name: tert-butyl 2-[2-(3-ethoxy-3-oxidanylidene-propyl)sulfanyl-3-[2-(2-ethylphenyl)ethanoylamino]-4-oxidanylidene-azetidin-1-yl]-3-methyl-but-2-enoate Openeye Name: tert-butyl 2-[2-(3-ethoxy-3-oxo-propyl)sulfanyl-3-[[2-(2-ethylphenyl)acetyl]amino]-4-oxo-azetidin-1-yl]-3-methyl-but-2-enoate CAS Name: 2-[2-[(3-ethoxy-3-oxopropyl)thio]-3-[[2-(2-ethylphenyl)-1-oxoethyl]amino]-4-oxo-1-azetidinyl]-3-methyl-2-butenoic acid tert-butyl ester IUPAC Name: tert-butyl 2-[2-(3-ethoxy-3-oxopropyl)sulfanyl-3-[[2-(2-ethylphenyl)acetyl]amino]-4-oxoazetidin-1-yl]-3-methylbut-2-enoate Traditional Name: 2-[2-[(3-ethoxy-3-keto-propyl)thio]-3-[[2-(2-ethylphenyl)acetyl]amino]-4-keto-azetidin-1-yl]-3-methyl-but-2-enoic acid tert-butyl ester Formula: C27H38N2O6S MolecularWeight: 518.66542

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1CC(=O)NC2C(N(C2=O)C(=C(C)C)C(=O)OC(C)(C)C)SCCC(=O)OCC

Isomeric SMILES

CCC1=CC=CC=C1CC(=O)NC2C(N(C2=O)C(=C(C)C)C(=O)OC(C)(C)C)SCCC(=O)OCC

InChI

InChI=1S/C27H38N2O6S/c1-8-18-12-10-11-13-19(18)16-20(30)28-22-24(32)29(25(22)36-15-14-21(31)34-9-2)23(17(3)4)26(33)35-27(5,6)7/h10-13,22,25H,8-9,14-16H2,1-7H3,(H,28,30)