[3-(4-methyl-2-phenylimino-1,3-thiazol-3-yl)-1-oxidanyl-1-phosphono-propyl]phosphonic acid

Systemtic Name: [3-(4-methyl-2-phenylimino-1,3-thiazol-3-yl)-1-oxidanyl-1-phosphono-propyl]phosphonic acid Openeye Name: [1-hydroxy-3-(4-methyl-2-phenylimino-thiazol-3-yl)-1-phosphono-propyl]phosphonic acid CAS Name: [1-hydroxy-3-(4-methyl-2-phenylimino-3-thiazolyl)-1-phosphonopropyl]phosphonic acid IUPAC Name: [1-hydroxy-3-(4-methyl-2-phenylimino-1,3-thiazol-3-yl)-1-phosphonopropyl]phosphonic acid Traditional Name: [1-hydroxy-3-(4-methyl-2-phenylimino-4-thiazolin-3-yl)-1-phosphono-propyl]phosphonic acid Formula: C13H18N2O7P2S MolecularWeight: 408.303742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=NC2=CC=CC=C2)N1CCC(O)(P(=O)(O)O)P(=O)(O)O

Isomeric SMILES

CC1=CSC(=NC2=CC=CC=C2)N1CCC(O)(P(=O)(O)O)P(=O)(O)O

InChI

InChI=1S/C13H18N2O7P2S/c1-10-9-25-12(14-11-5-3-2-4-6-11)15(10)8-7-13(16,23(17,18)19)24(20,21)22/h2-6,9,16H,7-8H2,1H3,(H2,17,18,19)(H2,20,21,22)