3-[(5-chloranyl-1-methyl-benzimidazol-2-yl)methylsulfanyl]-5-(4-methylphenyl)-1,2,4-triazol-4-amine

Systemtic Name: 3-[(5-chloranyl-1-methyl-benzimidazol-2-yl)methylsulfanyl]-5-(4-methylphenyl)-1,2,4-triazol-4-amine Openeye Name: 3-[(5-chloro-1-methyl-benzimidazol-2-yl)methylsulfanyl]-5-(p-tolyl)-1,2,4-triazol-4-amine CAS Name: 3-[(5-chloro-1-methyl-2-benzimidazolyl)methylthio]-5-(4-methylphenyl)-1,2,4-triazol-4-amine IUPAC Name: 3-[(5-chloro-1-methylbenzimidazol-2-yl)methylsulfanyl]-5-(4-methylphenyl)-1,2,4-triazol-4-amine Traditional Name: [3-[(5-chloro-1-methyl-benzimidazol-2-yl)methylthio]-5-(p-tolyl)-1,2,4-triazol-4-yl]amine Formula: C18H17ClN6S MolecularWeight: 384.88578

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN=C(N2N)SCC3=NC4=C(N3C)C=CC(=C4)Cl

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN=C(N2N)SCC3=NC4=C(N3C)C=CC(=C4)Cl

InChI

InChI=1S/C18H17ClN6S/c1-11-3-5-12(6-4-11)17-22-23-18(25(17)20)26-10-16-21-14-9-13(19)7-8-15(14)24(16)2/h3-9H,10,20H2,1-2H3