1-cyclopropylethyl 3-methyl-2-[2-oxidanylidene-3-(2-phenoxyethanoylamino)-4-(propylaminosulfanyl)azetidin-1-yl]but-3-enoate

Systemtic Name: 1-cyclopropylethyl 3-methyl-2-[2-oxidanylidene-3-(2-phenoxyethanoylamino)-4-(propylaminosulfanyl)azetidin-1-yl]but-3-enoate Openeye Name: 1-cyclopropylethyl 3-methyl-2-[2-oxo-3-[(2-phenoxyacetyl)amino]-4-(propylaminosulfanyl)azetidin-1-yl]but-3-enoate CAS Name: 3-methyl-2-[2-oxo-3-[(1-oxo-2-phenoxyethyl)amino]-4-(propylaminothio)-1-azetidinyl]-3-butenoic acid 1-cyclopropylethyl ester IUPAC Name: 1-cyclopropylethyl 3-methyl-2-[2-oxo-3-[(2-phenoxyacetyl)amino]-4-(propylaminosulfanyl)azetidin-1-yl]but-3-enoate Traditional Name: 2-[2-keto-3-[(2-phenoxyacetyl)amino]-4-(propylaminothio)azetidin-1-yl]-3-methyl-but-3-enoic acid 1-cyclopropylethyl ester Formula: C24H33N3O5S MolecularWeight: 475.60092

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Descriptors Computed from Structure

Canonical SMILES:

CCCNSC1C(C(=O)N1C(C(=C)C)C(=O)OC(C)C2CC2)NC(=O)COC3=CC=CC=C3

Isomeric SMILES

CCCNSC1C(C(=O)N1C(C(=C)C)C(=O)OC(C)C2CC2)NC(=O)COC3=CC=CC=C3

InChI

InChI=1S/C24H33N3O5S/c1-5-13-25-33-23-20(26-19(28)14-31-18-9-7-6-8-10-18)22(29)27(23)21(15(2)3)24(30)32-16(4)17-11-12-17/h6-10,16-17,20-21,23,25H,2,5,11-14H2,1,3-4H3,(H,26,28)