4-[(E)-(5-bromanylthiophen-2-yl)methylideneamino]-3-(4-tert-butylphenyl)-1H-1,2,4-triazole-5-thione

Systemtic Name: 4-[(E)-(5-bromanylthiophen-2-yl)methylideneamino]-3-(4-tert-butylphenyl)-1H-1,2,4-triazole-5-thione Openeye Name: 4-[(E)-(5-bromo-2-thienyl)methyleneamino]-3-(4-tert-butylphenyl)-1H-1,2,4-triazole-5-thione CAS Name: 4-[(E)-(5-bromo-2-thiophenyl)methylideneamino]-3-(4-tert-butylphenyl)-1H-1,2,4-triazole-5-thione IUPAC Name: 4-[(E)-(5-bromothiophen-2-yl)methylideneamino]-3-(4-tert-butylphenyl)-1H-1,2,4-triazole-5-thione Traditional Name: 4-[(E)-(5-bromo-2-thienyl)methyleneamino]-3-(4-tert-butylphenyl)-1H-1,2,4-triazole-5-thione Formula: C17H17BrN4S2 MolecularWeight: 421.37768

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=NNC(=S)N2N=CC3=CC=C(S3)Br

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=NNC(=S)N2/N=C/C3=CC=C(S3)Br

InChI

InChI=1S/C17H17BrN4S2/c1-17(2,3)12-6-4-11(5-7-12)15-20-21-16(23)22(15)19-10-13-8-9-14(18)24-13/h4-10H,1-3H3,(H,21,23)/b19-10+