[5-[5-(2-methylpropyl)-2-pyridin-3-yl-1,3-thiazol-4-yl]furan-3-yl]phosphonic acid

Systemtic Name: [5-[5-(2-methylpropyl)-2-pyridin-3-yl-1,3-thiazol-4-yl]furan-3-yl]phosphonic acid Openeye Name: [5-[5-isobutyl-2-(3-pyridyl)thiazol-4-yl]-3-furyl]phosphonic acid CAS Name: [5-[5-(2-methylpropyl)-2-(3-pyridinyl)-4-thiazolyl]-3-furanyl]phosphonic acid IUPAC Name: [5-[5-(2-methylpropyl)-2-pyridin-3-yl-1,3-thiazol-4-yl]furan-3-yl]phosphonic acid Traditional Name: [5-[5-isobutyl-2-(3-pyridyl)thiazol-4-yl]-3-furyl]phosphonic acid Formula: C16H17N2O4PS MolecularWeight: 364.355941

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=C(N=C(S1)C2=CN=CC=C2)C3=CC(=CO3)P(=O)(O)O

Isomeric SMILES

CC(C)CC1=C(N=C(S1)C2=CN=CC=C2)C3=CC(=CO3)P(=O)(O)O

InChI

InChI=1S/C16H17N2O4PS/c1-10(2)6-14-15(13-7-12(9-22-13)23(19,20)21)18-16(24-14)11-4-3-5-17-8-11/h3-5,7-10H,6H2,1-2H3,(H2,19,20,21)