(diphenylmethyl) 2-[3-(butanoylamino)-2-chloranylsulfinyl-4-oxidanylidene-azetidin-1-yl]-3-methyl-but-3-enoate

Systemtic Name: (diphenylmethyl) 2-[3-(butanoylamino)-2-chloranylsulfinyl-4-oxidanylidene-azetidin-1-yl]-3-methyl-but-3-enoate Openeye Name: benzhydryl 2-[3-(butanoylamino)-2-chlorosulfinyl-4-oxo-azetidin-1-yl]-3-methyl-but-3-enoate CAS Name: 2-[2-chlorosulfinyl-4-oxo-3-(1-oxobutylamino)-1-azetidinyl]-3-methyl-3-butenoic acid (diphenylmethyl) ester IUPAC Name: benzhydryl 2-[3-(butanoylamino)-2-chlorosulfinyl-4-oxoazetidin-1-yl]-3-methylbut-3-enoate Traditional Name: 2-(3-butyramido-2-chlorosulfinyl-4-keto-azetidin-1-yl)-3-methyl-but-3-enoic acid benzhydryl ester Formula: C25H27ClN2O5S MolecularWeight: 503.01028

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1C(N(C1=O)C(C(=C)C)C(=O)OC(C2=CC=CC=C2)C3=CC=CC=C3)S(=O)Cl

Isomeric SMILES

CCCC(=O)NC1C(N(C1=O)C(C(=C)C)C(=O)OC(C2=CC=CC=C2)C3=CC=CC=C3)S(=O)Cl

InChI

InChI=1S/C25H27ClN2O5S/c1-4-11-19(29)27-20-23(30)28(24(20)34(26)32)21(16(2)3)25(31)33-22(17-12-7-5-8-13-17)18-14-9-6-10-15-18/h5-10,12-15,20-22,24H,2,4,11H2,1,3H3,(H,27,29)