3-[4-(furan-2-ylmethyl)-5-(2-phenoxyethylsulfanyl)-1,2,4-triazol-3-yl]propanamide

Systemtic Name: 3-[4-(furan-2-ylmethyl)-5-(2-phenoxyethylsulfanyl)-1,2,4-triazol-3-yl]propanamide Openeye Name: 3-[4-(2-furylmethyl)-5-(2-phenoxyethylsulfanyl)-1,2,4-triazol-3-yl]propanamide CAS Name: 3-[4-(2-furanylmethyl)-5-(2-phenoxyethylthio)-1,2,4-triazol-3-yl]propanamide IUPAC Name: 3-[4-(furan-2-ylmethyl)-5-(2-phenoxyethylsulfanyl)-1,2,4-triazol-3-yl]propanamide Traditional Name: 3-[4-(2-furfuryl)-5-(2-phenoxyethylthio)-1,2,4-triazol-3-yl]propionamide Formula: C18H20N4O3S MolecularWeight: 372.4414

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCCSC2=NN=C(N2CC3=CC=CO3)CCC(=O)N

Isomeric SMILES

C1=CC=C(C=C1)OCCSC2=NN=C(N2CC3=CC=CO3)CCC(=O)N

InChI

InChI=1S/C18H20N4O3S/c19-16(23)8-9-17-20-21-18(22(17)13-15-7-4-10-24-15)26-12-11-25-14-5-2-1-3-6-14/h1-7,10H,8-9,11-13H2,(H2,19,23)