3-[(3-chlorophenyl)methylsulfanyl]-5-(2-methylfuran-3-yl)-1,2,4-triazol-4-amine

Systemtic Name: 3-[(3-chlorophenyl)methylsulfanyl]-5-(2-methylfuran-3-yl)-1,2,4-triazol-4-amine Openeye Name: 3-[(3-chlorophenyl)methylsulfanyl]-5-(2-methyl-3-furyl)-1,2,4-triazol-4-amine CAS Name: 3-[(3-chlorophenyl)methylthio]-5-(2-methyl-3-furanyl)-1,2,4-triazol-4-amine IUPAC Name: 3-[(3-chlorophenyl)methylsulfanyl]-5-(2-methylfuran-3-yl)-1,2,4-triazol-4-amine Traditional Name: [3-[(3-chlorobenzyl)thio]-5-(2-methyl-3-furyl)-1,2,4-triazol-4-yl]amine Formula: C14H13ClN4OS MolecularWeight: 320.79722

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CO1)C2=NN=C(N2N)SCC3=CC(=CC=C3)Cl

Isomeric SMILES

CC1=C(C=CO1)C2=NN=C(N2N)SCC3=CC(=CC=C3)Cl

InChI

InChI=1S/C14H13ClN4OS/c1-9-12(5-6-20-9)13-17-18-14(19(13)16)21-8-10-3-2-4-11(15)7-10/h2-7H,8,16H2,1H3