(diphenylmethyl) (E)-4-bromanyl-2-[3-[ethanoyl(thiophen-2-yl)amino]-2-oxidanylidene-azetidin-1-yl]-3-methyl-but-2-enoate

Systemtic Name: (diphenylmethyl) (E)-4-bromanyl-2-[3-[ethanoyl(thiophen-2-yl)amino]-2-oxidanylidene-azetidin-1-yl]-3-methyl-but-2-enoate Openeye Name: benzhydryl (E)-2-[3-[acetyl(2-thienyl)amino]-2-oxo-azetidin-1-yl]-4-bromo-3-methyl-but-2-enoate CAS Name: (E)-2-[3-[acetyl(thiophen-2-yl)amino]-2-oxo-1-azetidinyl]-4-bromo-3-methyl-2-butenoic acid (diphenylmethyl) ester IUPAC Name: benzhydryl (E)-2-[3-[acetyl(thiophen-2-yl)amino]-2-oxoazetidin-1-yl]-4-bromo-3-methylbut-2-enoate Traditional Name: (E)-2-[3-[acetyl(2-thienyl)amino]-2-keto-azetidin-1-yl]-4-bromo-3-methyl-but-2-enoic acid benzhydryl ester Formula: C27H25BrN2O4S MolecularWeight: 553.4674

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C(=O)OC(C1=CC=CC=C1)C2=CC=CC=C2)N3CC(C3=O)N(C4=CC=CS4)C(=O)C)CBr

Isomeric SMILES

C/C(=C(/C(=O)OC(C1=CC=CC=C1)C2=CC=CC=C2)\N3CC(C3=O)N(C4=CC=CS4)C(=O)C)/CBr

InChI

InChI=1S/C27H25BrN2O4S/c1-18(16-28)24(29-17-22(26(29)32)30(19(2)31)23-14-9-15-35-23)27(33)34-25(20-10-5-3-6-11-20)21-12-7-4-8-13-21/h3-15,22,25H,16-17H2,1-2H3/b24-18+