N-[[4-(2,5-dimethylphenyl)-5-methyl-1,3-thiazol-2-yl]carbamothioyl]-4-propoxy-benzamide

Systemtic Name: N-[[4-(2,5-dimethylphenyl)-5-methyl-1,3-thiazol-2-yl]carbamothioyl]-4-propoxy-benzamide Openeye Name: N-[[4-(2,5-dimethylphenyl)-5-methyl-thiazol-2-yl]carbamothioyl]-4-propoxy-benzamide CAS Name: N-[[[4-(2,5-dimethylphenyl)-5-methyl-2-thiazolyl]amino]-sulfanylidenemethyl]-4-propoxybenzamide IUPAC Name: N-[[4-(2,5-dimethylphenyl)-5-methyl-1,3-thiazol-2-yl]carbamothioyl]-4-propoxybenzamide Traditional Name: N-[[4-(2,5-dimethylphenyl)-5-methyl-thiazol-2-yl]thiocarbamoyl]-4-propoxy-benzamide Formula: C23H25N3O2S2 MolecularWeight: 439.5935

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=NC(=C(S2)C)C3=C(C=CC(=C3)C)C

Isomeric SMILES

CCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=NC(=C(S2)C)C3=C(C=CC(=C3)C)C

InChI

InChI=1S/C23H25N3O2S2/c1-5-12-28-18-10-8-17(9-11-18)21(27)25-22(29)26-23-24-20(16(4)30-23)19-13-14(2)6-7-15(19)3/h6-11,13H,5,12H2,1-4H3,(H2,24,25,26,27,29)