4-[(Z)-(5-bromanylthiophen-2-yl)methylideneamino]-5-(4-tert-butylphenyl)-1,2,4-triazole-3-thiolate

Systemtic Name: 4-[(Z)-(5-bromanylthiophen-2-yl)methylideneamino]-5-(4-tert-butylphenyl)-1,2,4-triazole-3-thiolate Openeye Name: 4-[(Z)-(5-bromo-2-thienyl)methyleneamino]-5-(4-tert-butylphenyl)-1,2,4-triazole-3-thiolate CAS Name: 4-[(Z)-(5-bromo-2-thiophenyl)methylideneamino]-5-(4-tert-butylphenyl)-1,2,4-triazole-3-thiolate IUPAC Name: 4-[(Z)-(5-bromothiophen-2-yl)methylideneamino]-5-(4-tert-butylphenyl)-1,2,4-triazole-3-thiolate Traditional Name: 4-[(Z)-(5-bromo-2-thienyl)methyleneamino]-5-(4-tert-butylphenyl)-1,2,4-triazole-3-thiolate Formula: C17H16BrN4S2- MolecularWeight: 420.36974

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=NN=C(N2N=CC3=CC=C(S3)Br)[S-]

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=NN=C(N2/N=C\C3=CC=C(S3)Br)[S-]

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)/p-1/b19-10-