5-thiophen-3-yl-N-[3-(1,2,4-triazol-1-yl)propyl]-1,2-oxazole-3-carboxamide

Systemtic Name: 5-thiophen-3-yl-N-[3-(1,2,4-triazol-1-yl)propyl]-1,2-oxazole-3-carboxamide Openeye Name: 5-(3-thienyl)-N-[3-(1,2,4-triazol-1-yl)propyl]isoxazole-3-carboxamide CAS Name: 5-(3-thiophenyl)-N-[3-(1,2,4-triazol-1-yl)propyl]-3-isoxazolecarboxamide IUPAC Name: 5-thiophen-3-yl-N-[3-(1,2,4-triazol-1-yl)propyl]-1,2-oxazole-3-carboxamide Traditional Name: 5-(3-thienyl)-N-[3-(1,2,4-triazol-1-yl)propyl]isoxazole-3-carboxamide Formula: C13H13N5O2S MolecularWeight: 303.33962

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC=C1C2=CC(=NO2)C(=O)NCCCN3C=NC=N3

Isomeric SMILES

C1=CSC=C1C2=CC(=NO2)C(=O)NCCCN3C=NC=N3

InChI

InChI=1S/C13H13N5O2S/c19-13(15-3-1-4-18-9-14-8-16-18)11-6-12(20-17-11)10-2-5-21-7-10/h2,5-9H,1,3-4H2,(H,15,19)