[2-[2-azanyl-5-(2-methylpropyl)-1,3-thiazol-4-yl]furan-3-yl]phosphonic acid; bicyclo[3.1.0]hexa-1(6),2,4-triene

Systemtic Name: [2-[2-azanyl-5-(2-methylpropyl)-1,3-thiazol-4-yl]furan-3-yl]phosphonic acid; bicyclo[3.1.0]hexa-1(6),2,4-triene Openeye Name: [2-(2-amino-5-isobutyl-thiazol-4-yl)-3-furyl]phosphonic acid; bicyclo[3.1.0]hexa-1(6),2,4-triene CAS Name: [2-[2-amino-5-(2-methylpropyl)-4-thiazolyl]-3-furanyl]phosphonic acid; bicyclo[3.1.0]hexa-1(6),2,4-triene IUPAC Name: [2-[2-amino-5-(2-methylpropyl)-1,3-thiazol-4-yl]furan-3-yl]phosphonic acid; bicyclo[3.1.0]hexa-1(6),2,4-triene Traditional Name: [2-(2-amino-5-isobutyl-thiazol-4-yl)-3-furyl]phosphonic acid; bicyclo[3.1.0]hexa-1(6),2,4-triene Formula: C17H19N2O4PS MolecularWeight: 378.382521

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=C(N=C(S1)N)C2=C(C=CO2)P(=O)(O)O.C1=CC2=CC2=C1

Isomeric SMILES

CC(C)CC1=C(N=C(S1)N)C2=C(C=CO2)P(=O)(O)O.C1=CC2=CC2=C1

InChI

InChI=1S/C11H15N2O4PS.C6H4/c1-6(2)5-8-9(13-11(12)19-8)10-7(3-4-17-10)18(14,15)16;1-2-5-4-6(5)3-1/h3-4,6H,5H2,1-2H3,(H2,12,13)(H2,14,15,16);1-4H