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

Systemtic Name: 3-[3-(furan-2-yl)-5-(3-phenoxypropylsulfanyl)-1,2,4-triazol-4-yl]propanamide Openeye Name: 3-[3-(2-furyl)-5-(3-phenoxypropylsulfanyl)-1,2,4-triazol-4-yl]propanamide CAS Name: 3-[3-(2-furanyl)-5-(3-phenoxypropylthio)-1,2,4-triazol-4-yl]propanamide IUPAC Name: 3-[3-(furan-2-yl)-5-(3-phenoxypropylsulfanyl)-1,2,4-triazol-4-yl]propanamide Traditional Name: 3-[3-(2-furyl)-5-(3-phenoxypropylthio)-1,2,4-triazol-4-yl]propionamide Formula: C18H20N4O3S MolecularWeight: 372.4414

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OCCCSC2=NN=C(N2CCC(=O)N)C3=CC=CO3

Isomeric SMILES

C1=CC=C(C=C1)OCCCSC2=NN=C(N2CCC(=O)N)C3=CC=CO3

InChI

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