N-[[4-(5-butan-2-yl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl]-2-(3,4-dimethylphenoxy)ethanamide

Systemtic Name: N-[[4-(5-butan-2-yl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl]-2-(3,4-dimethylphenoxy)ethanamide Openeye Name: 2-(3,4-dimethylphenoxy)-N-[[4-(5-sec-butyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl]acetamide CAS Name: N-[[4-(5-butan-2-yl-1,3-benzoxazol-2-yl)anilino]-sulfanylidenemethyl]-2-(3,4-dimethylphenoxy)acetamide IUPAC Name: N-[[4-(5-butan-2-yl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl]-2-(3,4-dimethylphenoxy)acetamide Traditional Name: 2-(3,4-dimethylphenoxy)-N-[[4-(5-sec-butyl-1,3-benzoxazol-2-yl)phenyl]thiocarbamoyl]acetamide Formula: C28H29N3O3S MolecularWeight: 487.61316

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC2=C(C=C1)OC(=N2)C3=CC=C(C=C3)NC(=S)NC(=O)COC4=CC(=C(C=C4)C)C

Isomeric SMILES

CCC(C)C1=CC2=C(C=C1)OC(=N2)C3=CC=C(C=C3)NC(=S)NC(=O)COC4=CC(=C(C=C4)C)C

InChI

InChI=1S/C28H29N3O3S/c1-5-17(2)21-9-13-25-24(15-21)30-27(34-25)20-7-10-22(11-8-20)29-28(35)31-26(32)16-33-23-12-6-18(3)19(4)14-23/h6-15,17H,5,16H2,1-4H3,(H2,29,31,32,35)