2-(4-tert-butylphenoxy)-N-[[2-(4-ethoxyphenyl)-1,3-benzoxazol-5-yl]carbamothioyl]ethanamide

Systemtic Name: 2-(4-tert-butylphenoxy)-N-[[2-(4-ethoxyphenyl)-1,3-benzoxazol-5-yl]carbamothioyl]ethanamide Openeye Name: 2-(4-tert-butylphenoxy)-N-[[2-(4-ethoxyphenyl)-1,3-benzoxazol-5-yl]carbamothioyl]acetamide CAS Name: 2-(4-tert-butylphenoxy)-N-[[[2-(4-ethoxyphenyl)-1,3-benzoxazol-5-yl]amino]-sulfanylidenemethyl]acetamide IUPAC Name: 2-(4-tert-butylphenoxy)-N-[[2-(4-ethoxyphenyl)-1,3-benzoxazol-5-yl]carbamothioyl]acetamide Traditional Name: 2-(4-tert-butylphenoxy)-N-[(2-p-phenetyl-1,3-benzoxazol-5-yl)thiocarbamoyl]acetamide Formula: C28H29N3O4S MolecularWeight: 503.61256

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NC3=C(O2)C=CC(=C3)NC(=S)NC(=O)COC4=CC=C(C=C4)C(C)(C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NC3=C(O2)C=CC(=C3)NC(=S)NC(=O)COC4=CC=C(C=C4)C(C)(C)C

InChI

InChI=1S/C28H29N3O4S/c1-5-33-21-11-6-18(7-12-21)26-30-23-16-20(10-15-24(23)35-26)29-27(36)31-25(32)17-34-22-13-8-19(9-14-22)28(2,3)4/h6-16H,5,17H2,1-4H3,(H2,29,31,32,36)