(4R,5S,6S)-4-methyl-3-[2-[(3-methyl-1,3,4-thiadiazol-2-ylidene)amino]-2-oxidanylidene-ethyl]sulfanyl-6-[(1R)-1-oxidanylethyl]-7-oxidanylidene-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid

Systemtic Name: (4R,5S,6S)-4-methyl-3-[2-[(3-methyl-1,3,4-thiadiazol-2-ylidene)amino]-2-oxidanylidene-ethyl]sulfanyl-6-[(1R)-1-oxidanylethyl]-7-oxidanylidene-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Openeye Name: (4R,5S,6S)-6-[(1R)-1-hydroxyethyl]-4-methyl-3-[2-[(3-methyl-1,3,4-thiadiazol-2-ylidene)amino]-2-oxo-ethyl]sulfanyl-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid CAS Name: (4R,5S,6S)-6-[(1R)-1-hydroxyethyl]-4-methyl-3-[[2-[(3-methyl-1,3,4-thiadiazol-2-ylidene)amino]-2-oxoethyl]thio]-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid IUPAC Name: (4R,5S,6S)-6-[(1R)-1-hydroxyethyl]-4-methyl-3-[2-[(3-methyl-1,3,4-thiadiazol-2-ylidene)amino]-2-oxoethyl]sulfanyl-7-oxo-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Traditional Name: (4R,5S,6S)-6-[(1R)-1-hydroxyethyl]-7-keto-3-[[2-keto-2-[(3-methyl-1,3,4-thiadiazol-2-ylidene)amino]ethyl]thio]-4-methyl-1-azabicyclo[3.2.0]hept-2-ene-2-carboxylic acid Formula: C15H18N4O5S2 MolecularWeight: 398.45722

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2C(C(=O)N2C(=C1SCC(=O)N=C3N(N=CS3)C)C(=O)O)C(C)O

Isomeric SMILES

C[C@@H]1[C@@H]2[C@H](C(=O)N2C(=C1SCC(=O)N=C3N(N=CS3)C)C(=O)O)[C@@H](C)O

InChI

InChI=1S/C15H18N4O5S2/c1-6-10-9(7(2)20)13(22)19(10)11(14(23)24)12(6)25-4-8(21)17-15-18(3)16-5-26-15/h5-7,9-10,20H,4H2,1-3H3,(H,23,24)/t6-,7-,9-,10-/m1/s1