(1E)-1-[4-(4-tert-butylphenyl)-5-(1-oxidanylpyridin-4-ylidene)-1,3-thiazol-2-ylidene]-3-propyl-urea

Systemtic Name: (1E)-1-[4-(4-tert-butylphenyl)-5-(1-oxidanylpyridin-4-ylidene)-1,3-thiazol-2-ylidene]-3-propyl-urea Openeye Name: (1E)-1-[4-(4-tert-butylphenyl)-5-(1-hydroxy-4-pyridylidene)thiazol-2-ylidene]-3-propyl-urea CAS Name: (1E)-1-[4-(4-tert-butylphenyl)-5-(1-hydroxy-4-pyridinylidene)-2-thiazolylidene]-3-propylurea IUPAC Name: (1E)-1-[4-(4-tert-butylphenyl)-5-(1-hydroxypyridin-4-ylidene)-1,3-thiazol-2-ylidene]-3-propylurea Traditional Name: (1E)-1-[4-(4-tert-butylphenyl)-5-(1-hydroxy-4-pyridylidene)-3-thiazolin-2-ylidene]-3-propyl-urea Formula: C22H26N4O2S MolecularWeight: 410.53244

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)N=C1N=C(C(=C2C=CN(C=C2)O)S1)C3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CCCNC(=O)/N=C/1\N=C(C(=C2C=CN(C=C2)O)S1)C3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C22H26N4O2S/c1-5-12-23-20(27)25-21-24-18(15-6-8-17(9-7-15)22(2,3)4)19(29-21)16-10-13-26(28)14-11-16/h6-11,13-14,28H,5,12H2,1-4H3,(H,23,27)/b25-21+