(2S)-2-(furan-2-ylcarbonylamino)-3-phenyl-N-(1H-1,2,4-triazol-5-yl)propanimidate

Systemtic Name: (2S)-2-(furan-2-ylcarbonylamino)-3-phenyl-N-(1H-1,2,4-triazol-5-yl)propanimidate Openeye Name: (2S)-2-(furan-2-carbonylamino)-3-phenyl-N-(1H-1,2,4-triazol-5-yl)propanimidate CAS Name: (2S)-2-[[2-furanyl(oxo)methyl]amino]-3-phenyl-N-(1H-1,2,4-triazol-5-yl)propanimidate IUPAC Name: (2S)-2-(furan-2-carbonylamino)-3-phenyl-N-(1H-1,2,4-triazol-5-yl)propanimidate Traditional Name: (2S)-2-(2-furoylamino)-3-phenyl-N-(1H-1,2,4-triazol-5-yl)propionimidate Formula: C16H14N5O3- MolecularWeight: 324.31406

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=NC2=NC=NN2)[O-])NC(=O)C3=CC=CO3

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H](C(=NC2=NC=NN2)[O-])NC(=O)C3=CC=CO3

InChI

InChI=1S/C16H15N5O3/c22-14(20-16-17-10-18-21-16)12(9-11-5-2-1-3-6-11)19-15(23)13-7-4-8-24-13/h1-8,10,12H,9H2,(H,19,23)(H2,17,18,20,21,22)/p-1/t12-/m0/s1