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

Systemtic Name: 3-[3-(3-methylphenoxy)propylsulfanyl]-5-thiophen-2-yl-1,2,4-triazol-4-amine Openeye Name: 3-[3-(3-methylphenoxy)propylsulfanyl]-5-(2-thienyl)-1,2,4-triazol-4-amine CAS Name: 3-[3-(3-methylphenoxy)propylthio]-5-thiophen-2-yl-1,2,4-triazol-4-amine IUPAC Name: 3-[3-(3-methylphenoxy)propylsulfanyl]-5-thiophen-2-yl-1,2,4-triazol-4-amine Traditional Name: [3-[3-(3-methylphenoxy)propylthio]-5-(2-thienyl)-1,2,4-triazol-4-yl]amine Formula: C16H18N4OS2 MolecularWeight: 346.47032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCCSC2=NN=C(N2N)C3=CC=CS3

Isomeric SMILES

CC1=CC(=CC=C1)OCCCSC2=NN=C(N2N)C3=CC=CS3

InChI

InChI=1S/C16H18N4OS2/c1-12-5-2-6-13(11-12)21-8-4-10-23-16-19-18-15(20(16)17)14-7-3-9-22-14/h2-3,5-7,9,11H,4,8,10,17H2,1H3