2-[2-(3-butoxy-3-oxidanylidene-propyl)sulfanyl-4-oxidanylidene-3-(2-phenoxyethanoylamino)azetidin-1-yl]-3-methyl-but-2-enoic acid

Systemtic Name: 2-[2-(3-butoxy-3-oxidanylidene-propyl)sulfanyl-4-oxidanylidene-3-(2-phenoxyethanoylamino)azetidin-1-yl]-3-methyl-but-2-enoic acid Openeye Name: 2-[2-(3-butoxy-3-oxo-propyl)sulfanyl-4-oxo-3-[(2-phenoxyacetyl)amino]azetidin-1-yl]-3-methyl-but-2-enoic acid CAS Name: 2-[2-[(3-butoxy-3-oxopropyl)thio]-4-oxo-3-[(1-oxo-2-phenoxyethyl)amino]-1-azetidinyl]-3-methyl-2-butenoic acid IUPAC Name: 2-[2-(3-butoxy-3-oxopropyl)sulfanyl-4-oxo-3-[(2-phenoxyacetyl)amino]azetidin-1-yl]-3-methylbut-2-enoic acid Traditional Name: 2-[2-[(3-butoxy-3-keto-propyl)thio]-4-keto-3-[(2-phenoxyacetyl)amino]azetidin-1-yl]-3-methyl-but-2-enoic acid Formula: C23H30N2O7S MolecularWeight: 478.5585

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)CCSC1C(C(=O)N1C(=C(C)C)C(=O)O)NC(=O)COC2=CC=CC=C2

Isomeric SMILES

CCCCOC(=O)CCSC1C(C(=O)N1C(=C(C)C)C(=O)O)NC(=O)COC2=CC=CC=C2

InChI

InChI=1S/C23H30N2O7S/c1-4-5-12-31-18(27)11-13-33-22-19(21(28)25(22)20(15(2)3)23(29)30)24-17(26)14-32-16-9-7-6-8-10-16/h6-10,19,22H,4-5,11-14H2,1-3H3,(H,24,26)(H,29,30)