4-tert-butyl-N-[[4-(4-phenoxyphenyl)-1,3-thiazol-2-yl]carbamothioyl]benzamide

Systemtic Name: 4-tert-butyl-N-[[4-(4-phenoxyphenyl)-1,3-thiazol-2-yl]carbamothioyl]benzamide Openeye Name: 4-tert-butyl-N-[[4-(4-phenoxyphenyl)thiazol-2-yl]carbamothioyl]benzamide CAS Name: 4-tert-butyl-N-[[[4-(4-phenoxyphenyl)-2-thiazolyl]amino]-sulfanylidenemethyl]benzamide IUPAC Name: 4-tert-butyl-N-[[4-(4-phenoxyphenyl)-1,3-thiazol-2-yl]carbamothioyl]benzamide Traditional Name: 4-tert-butyl-N-[[4-(4-phenoxyphenyl)thiazol-2-yl]thiocarbamoyl]benzamide Formula: C27H25N3O2S2 MolecularWeight: 487.6363

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NC(=S)NC2=NC(=CS2)C3=CC=C(C=C3)OC4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NC(=S)NC2=NC(=CS2)C3=CC=C(C=C3)OC4=CC=CC=C4

InChI

InChI=1S/C27H25N3O2S2/c1-27(2,3)20-13-9-19(10-14-20)24(31)29-25(33)30-26-28-23(17-34-26)18-11-15-22(16-12-18)32-21-7-5-4-6-8-21/h4-17H,1-3H3,(H2,28,29,30,31,33)