3-(2-methylfuran-3-yl)-5-[3-(3-methylphenoxy)propylsulfanyl]-1,2,4-triazol-4-amine

Systemtic Name: 3-(2-methylfuran-3-yl)-5-[3-(3-methylphenoxy)propylsulfanyl]-1,2,4-triazol-4-amine Openeye Name: 3-(2-methyl-3-furyl)-5-[3-(3-methylphenoxy)propylsulfanyl]-1,2,4-triazol-4-amine CAS Name: 3-(2-methyl-3-furanyl)-5-[3-(3-methylphenoxy)propylthio]-1,2,4-triazol-4-amine IUPAC Name: 3-(2-methylfuran-3-yl)-5-[3-(3-methylphenoxy)propylsulfanyl]-1,2,4-triazol-4-amine Traditional Name: [3-(2-methyl-3-furyl)-5-[3-(3-methylphenoxy)propylthio]-1,2,4-triazol-4-yl]amine Formula: C17H20N4O2S MolecularWeight: 344.4313

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCCSC2=NN=C(N2N)C3=C(OC=C3)C

Isomeric SMILES

CC1=CC(=CC=C1)OCCCSC2=NN=C(N2N)C3=C(OC=C3)C

InChI

InChI=1S/C17H20N4O2S/c1-12-5-3-6-14(11-12)23-8-4-10-24-17-20-19-16(21(17)18)15-7-9-22-13(15)2/h3,5-7,9,11H,4,8,10,18H2,1-2H3