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

Systemtic Name: 2-(4-tert-butylphenoxy)-N-[[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]carbamothioyl]ethanamide Openeye Name: 2-(4-tert-butylphenoxy)-N-[[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]carbamothioyl]acetamide CAS Name: 2-(4-tert-butylphenoxy)-N-[[4-(6-methyl-1,3-benzothiazol-2-yl)anilino]-sulfanylidenemethyl]acetamide IUPAC Name: 2-(4-tert-butylphenoxy)-N-[[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]carbamothioyl]acetamide Traditional Name: 2-(4-tert-butylphenoxy)-N-[[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]thiocarbamoyl]acetamide Formula: C27H27N3O2S2 MolecularWeight: 489.65218

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=S)NC(=O)COC4=CC=C(C=C4)C(C)(C)C

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=S)NC(=O)COC4=CC=C(C=C4)C(C)(C)C

InChI

InChI=1S/C27H27N3O2S2/c1-17-5-14-22-23(15-17)34-25(29-22)18-6-10-20(11-7-18)28-26(33)30-24(31)16-32-21-12-8-19(9-13-21)27(2,3)4/h5-15H,16H2,1-4H3,(H2,28,30,31,33)