6-[[2-[2-[[azanyl-[3,5-bis(dimethylsulfamoyl)phenyl]methylidene]amino]ethanoylamino]-2-phenyl-ethanoyl]amino]-3,3-dimethyl-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid

Systemtic Name: 6-[[2-[2-[[azanyl-[3,5-bis(dimethylsulfamoyl)phenyl]methylidene]amino]ethanoylamino]-2-phenyl-ethanoyl]amino]-3,3-dimethyl-7-oxidanylidene-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid Openeye Name: 6-[[2-[[2-[[amino-[3,5-bis(dimethylsulfamoyl)phenyl]methylene]amino]acetyl]amino]-2-phenyl-acetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid CAS Name: 6-[[2-[[2-[[amino-[3,5-bis(dimethylsulfamoyl)phenyl]methylidene]amino]-1-oxoethyl]amino]-1-oxo-2-phenylethyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid IUPAC Name: 6-[[2-[[2-[[amino-[3,5-bis(dimethylsulfamoyl)phenyl]methylidene]amino]acetyl]amino]-2-phenylacetyl]amino]-3,3-dimethyl-7-oxo-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid Traditional Name: 6-[[2-[[2-[[amino-[3,5-bis(dimethylsulfamoyl)phenyl]methylene]amino]acetyl]amino]-2-phenyl-acetyl]amino]-7-keto-3,3-dimethyl-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylic acid Formula: C29H37N7O9S3 MolecularWeight: 723.84058

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(N2C(S1)C(C2=O)NC(=O)C(C3=CC=CC=C3)NC(=O)CN=C(C4=CC(=CC(=C4)S(=O)(=O)N(C)C)S(=O)(=O)N(C)C)N)C(=O)O)C

Isomeric SMILES

CC1(C(N2C(S1)C(C2=O)NC(=O)C(C3=CC=CC=C3)NC(=O)CN=C(C4=CC(=CC(=C4)S(=O)(=O)N(C)C)S(=O)(=O)N(C)C)N)C(=O)O)C

InChI

InChI=1S/C29H37N7O9S3/c1-29(2)23(28(40)41)36-26(39)22(27(36)46-29)33-25(38)21(16-10-8-7-9-11-16)32-20(37)15-31-24(30)17-12-18(47(42,43)34(3)4)14-19(13-17)48(44,45)35(5)6/h7-14,21-23,27H,15H2,1-6H3,(H2,30,31)(H,32,37)(H,33,38)(H,40,41)