3-(5-bromanylthiophen-2-yl)sulfanyl-N-(4-methylphenyl)-1H-1,2,4-triazol-5-amine

Systemtic Name: 3-(5-bromanylthiophen-2-yl)sulfanyl-N-(4-methylphenyl)-1H-1,2,4-triazol-5-amine Openeye Name: 3-[(5-bromo-2-thienyl)sulfanyl]-N-(p-tolyl)-1H-1,2,4-triazol-5-amine CAS Name: 3-[(5-bromo-2-thiophenyl)thio]-N-(4-methylphenyl)-1H-1,2,4-triazol-5-amine IUPAC Name: 3-(5-bromothiophen-2-yl)sulfanyl-N-(4-methylphenyl)-1H-1,2,4-triazol-5-amine Traditional Name: [3-[(5-bromo-2-thienyl)thio]-1H-1,2,4-triazol-5-yl]-(p-tolyl)amine Formula: C13H11BrN4S2 MolecularWeight: 367.28724

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=NC(=NN2)SC3=CC=C(S3)Br

Isomeric SMILES

CC1=CC=C(C=C1)NC2=NC(=NN2)SC3=CC=C(S3)Br

InChI

InChI=1S/C13H11BrN4S2/c1-8-2-4-9(5-3-8)15-12-16-13(18-17-12)20-11-7-6-10(14)19-11/h2-7H,1H3,(H2,15,16,17,18)