3-(4-tert-butylphenyl)-4-[(E)-(9-ethylcarbazol-3-yl)methylideneamino]-1H-1,2,4-triazole-5-thione

Systemtic Name: 3-(4-tert-butylphenyl)-4-[(E)-(9-ethylcarbazol-3-yl)methylideneamino]-1H-1,2,4-triazole-5-thione Openeye Name: 3-(4-tert-butylphenyl)-4-[(E)-(9-ethylcarbazol-3-yl)methyleneamino]-1H-1,2,4-triazole-5-thione CAS Name: 3-(4-tert-butylphenyl)-4-[(E)-(9-ethyl-3-carbazolyl)methylideneamino]-1H-1,2,4-triazole-5-thione IUPAC Name: 3-(4-tert-butylphenyl)-4-[(E)-(9-ethylcarbazol-3-yl)methylideneamino]-1H-1,2,4-triazole-5-thione Traditional Name: 3-(4-tert-butylphenyl)-4-[(E)-(9-ethylcarbazol-3-yl)methyleneamino]-1H-1,2,4-triazole-5-thione Formula: C27H27N5S MolecularWeight: 453.60178

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C=NN3C(=NNC3=S)C4=CC=C(C=C4)C(C)(C)C)C5=CC=CC=C51

Isomeric SMILES

CCN1C2=C(C=C(C=C2)/C=N/N3C(=NNC3=S)C4=CC=C(C=C4)C(C)(C)C)C5=CC=CC=C51

InChI

InChI=1S/C27H27N5S/c1-5-31-23-9-7-6-8-21(23)22-16-18(10-15-24(22)31)17-28-32-25(29-30-26(32)33)19-11-13-20(14-12-19)27(2,3)4/h6-17H,5H2,1-4H3,(H,30,33)/b28-17+