3-[[2-[bis(azanyl)methylideneamino]-1,3-thiazol-4-yl]oxycarbonyl]-5-methoxy-3-oxidanyl-5-oxidanylidene-pentanoic acid

Systemtic Name: 3-[[2-[bis(azanyl)methylideneamino]-1,3-thiazol-4-yl]oxycarbonyl]-5-methoxy-3-oxidanyl-5-oxidanylidene-pentanoic acid Openeye Name: 3-(2-guanidinothiazol-4-yl)oxycarbonyl-3-hydroxy-5-methoxy-5-oxo-pentanoic acid CAS Name: 3-[[2-(diaminomethylideneamino)-4-thiazolyl]oxy-oxomethyl]-3-hydroxy-5-methoxy-5-oxopentanoic acid IUPAC Name: 3-[[2-(diaminomethylideneamino)-1,3-thiazol-4-yl]oxycarbonyl]-3-hydroxy-5-methoxy-5-oxopentanoic acid Traditional Name: 3-(2-guanidinothiazol-4-yl)oxycarbonyl-3-hydroxy-5-keto-5-methoxy-valeric acid Formula: C11H14N4O7S MolecularWeight: 346.31646

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(CC(=O)O)(C(=O)OC1=CSC(=N1)N=C(N)N)O

Isomeric SMILES

COC(=O)CC(CC(=O)O)(C(=O)OC1=CSC(=N1)N=C(N)N)O

InChI

InChI=1S/C11H14N4O7S/c1-21-7(18)3-11(20,2-6(16)17)8(19)22-5-4-23-10(14-5)15-9(12)13/h4,20H,2-3H2,1H3,(H,16,17)(H4,12,13,14,15)