5-(4-tert-butylphenyl)-4-[(Z)-(1-ethyl-2-oxidanylidene-indol-3-ylidene)amino]-1,2,4-triazole-3-thiolate

Systemtic Name: 5-(4-tert-butylphenyl)-4-[(Z)-(1-ethyl-2-oxidanylidene-indol-3-ylidene)amino]-1,2,4-triazole-3-thiolate Openeye Name: 5-(4-tert-butylphenyl)-4-[(Z)-(1-ethyl-2-oxo-indolin-3-ylidene)amino]-1,2,4-triazole-3-thiolate CAS Name: 5-(4-tert-butylphenyl)-4-[(Z)-(1-ethyl-2-oxo-3-indolylidene)amino]-1,2,4-triazole-3-thiolate IUPAC Name: 5-(4-tert-butylphenyl)-4-[(Z)-(1-ethyl-2-oxoindol-3-ylidene)amino]-1,2,4-triazole-3-thiolate Traditional Name: 5-(4-tert-butylphenyl)-4-[(Z)-(1-ethyl-2-keto-indolin-3-ylidene)amino]-1,2,4-triazole-3-thiolate Formula: C22H22N5OS- MolecularWeight: 404.50798

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=CC=CC=C2C(=NN3C(=NN=C3[S-])C4=CC=C(C=C4)C(C)(C)C)C1=O

Isomeric SMILES

CCN1C2=CC=CC=C2/C(=N/N3C(=NN=C3[S-])C4=CC=C(C=C4)C(C)(C)C)/C1=O

InChI

InChI=1S/C22H23N5OS/c1-5-26-17-9-7-6-8-16(17)18(20(26)28)25-27-19(23-24-21(27)29)14-10-12-15(13-11-14)22(2,3)4/h6-13H,5H2,1-4H3,(H,24,29)/p-1/b25-18-