N-[(6-butyl-1,3-benzothiazol-2-yl)carbamothioyl]-2-(4-tert-butylphenoxy)ethanamide

Systemtic Name: N-[(6-butyl-1,3-benzothiazol-2-yl)carbamothioyl]-2-(4-tert-butylphenoxy)ethanamide Openeye Name: N-[(6-butyl-1,3-benzothiazol-2-yl)carbamothioyl]-2-(4-tert-butylphenoxy)acetamide CAS Name: N-[[(6-butyl-1,3-benzothiazol-2-yl)amino]-sulfanylidenemethyl]-2-(4-tert-butylphenoxy)acetamide IUPAC Name: N-[(6-butyl-1,3-benzothiazol-2-yl)carbamothioyl]-2-(4-tert-butylphenoxy)acetamide Traditional Name: N-[(6-butyl-1,3-benzothiazol-2-yl)thiocarbamoyl]-2-(4-tert-butylphenoxy)acetamide Formula: C24H29N3O2S2 MolecularWeight: 455.63596

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC2=C(C=C1)N=C(S2)NC(=S)NC(=O)COC3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CCCCC1=CC2=C(C=C1)N=C(S2)NC(=S)NC(=O)COC3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C24H29N3O2S2/c1-5-6-7-16-8-13-19-20(14-16)31-23(25-19)27-22(30)26-21(28)15-29-18-11-9-17(10-12-18)24(2,3)4/h8-14H,5-7,15H2,1-4H3,(H2,25,26,27,28,30)