tert-butyl 2-[3-[2-(4-methoxyphenyl)ethanoylamino]-2-(methylcarbamoylamino)sulfinamoyl-4-oxidanylidene-azetidin-1-yl]-3-methyl-but-3-enoate

Systemtic Name: tert-butyl 2-[3-[2-(4-methoxyphenyl)ethanoylamino]-2-(methylcarbamoylamino)sulfinamoyl-4-oxidanylidene-azetidin-1-yl]-3-methyl-but-3-enoate Openeye Name: tert-butyl 2-[3-[[2-(4-methoxyphenyl)acetyl]amino]-2-(methylcarbamoylamino)sulfinamoyl-4-oxo-azetidin-1-yl]-3-methyl-but-3-enoate CAS Name: 2-[3-[[2-(4-methoxyphenyl)-1-oxoethyl]amino]-2-(methylcarbamoylamino)sulfinamoyl-4-oxo-1-azetidinyl]-3-methyl-3-butenoic acid tert-butyl ester IUPAC Name: tert-butyl 2-[3-[[2-(4-methoxyphenyl)acetyl]amino]-2-(methylcarbamoylamino)sulfinamoyl-4-oxoazetidin-1-yl]-3-methylbut-3-enoate Traditional Name: 2-[2-keto-3-[[2-(4-methoxyphenyl)acetyl]amino]-4-(methylcarbamoylamino)sulfinamoyl-azetidin-1-yl]-3-methyl-but-3-enoic acid tert-butyl ester Formula: C23H33N5O7S MolecularWeight: 523.60242

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)C(C(=O)OC(C)(C)C)N1C(C(C1=O)NC(=O)CC2=CC=C(C=C2)OC)S(=O)NNC(=O)NC

Isomeric SMILES

CC(=C)C(C(=O)OC(C)(C)C)N1C(C(C1=O)NC(=O)CC2=CC=C(C=C2)OC)S(=O)NNC(=O)NC

InChI

InChI=1S/C23H33N5O7S/c1-13(2)18(21(31)35-23(3,4)5)28-19(30)17(20(28)36(33)27-26-22(32)24-6)25-16(29)12-14-8-10-15(34-7)11-9-14/h8-11,17-18,20,27H,1,12H2,2-7H3,(H,25,29)(H2,24,26,32)