3-[(6-chloranyl-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-5-(2-methylphenyl)-1,2,4-triazol-4-amine

Systemtic Name: 3-[(6-chloranyl-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-5-(2-methylphenyl)-1,2,4-triazol-4-amine Openeye Name: 3-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-5-(o-tolyl)-1,2,4-triazol-4-amine CAS Name: 3-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylthio]-5-(2-methylphenyl)-1,2,4-triazol-4-amine IUPAC Name: 3-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylsulfanyl]-5-(2-methylphenyl)-1,2,4-triazol-4-amine Traditional Name: [3-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylthio]-5-(o-tolyl)-1,2,4-triazol-4-yl]amine Formula: C18H17ClN4O2S MolecularWeight: 388.87118

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NN=C(N2N)SCC3=C4C(=CC(=C3)Cl)COCO4

Isomeric SMILES

CC1=CC=CC=C1C2=NN=C(N2N)SCC3=C4C(=CC(=C3)Cl)COCO4

InChI

InChI=1S/C18H17ClN4O2S/c1-11-4-2-3-5-15(11)17-21-22-18(23(17)20)26-9-13-7-14(19)6-12-8-24-10-25-16(12)13/h2-7H,8-10,20H2,1H3