[2-(2-thiophen-2-ylethanoylamino)-3-(1,2,4-triazol-1-yl)propyl]phosphonic acid

Systemtic Name: [2-(2-thiophen-2-ylethanoylamino)-3-(1,2,4-triazol-1-yl)propyl]phosphonic acid Openeye Name: [2-[[2-(2-thienyl)acetyl]amino]-3-(1,2,4-triazol-1-yl)propyl]phosphonic acid CAS Name: [2-[(1-oxo-2-thiophen-2-ylethyl)amino]-3-(1,2,4-triazol-1-yl)propyl]phosphonic acid IUPAC Name: [2-[(2-thiophen-2-ylacetyl)amino]-3-(1,2,4-triazol-1-yl)propyl]phosphonic acid Traditional Name: [2-[[2-(2-thienyl)acetyl]amino]-3-(1,2,4-triazol-1-yl)propyl]phosphonic acid Formula: C11H15N4O4PS MolecularWeight: 330.299961

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)CC(=O)NC(CN2C=NC=N2)CP(=O)(O)O

Isomeric SMILES

C1=CSC(=C1)CC(=O)NC(CN2C=NC=N2)CP(=O)(O)O

InChI

InChI=1S/C11H15N4O4PS/c16-11(4-10-2-1-3-21-10)14-9(6-20(17,18)19)5-15-8-12-7-13-15/h1-3,7-9H,4-6H2,(H,14,16)(H2,17,18,19)