N-[[4-(4-ethylphenyl)-5-methyl-1,3-thiazol-2-yl]carbamothioyl]-2,6-dimethoxy-benzamide

Systemtic Name: N-[[4-(4-ethylphenyl)-5-methyl-1,3-thiazol-2-yl]carbamothioyl]-2,6-dimethoxy-benzamide Openeye Name: N-[[4-(4-ethylphenyl)-5-methyl-thiazol-2-yl]carbamothioyl]-2,6-dimethoxy-benzamide CAS Name: N-[[[4-(4-ethylphenyl)-5-methyl-2-thiazolyl]amino]-sulfanylidenemethyl]-2,6-dimethoxybenzamide IUPAC Name: N-[[4-(4-ethylphenyl)-5-methyl-1,3-thiazol-2-yl]carbamothioyl]-2,6-dimethoxybenzamide Traditional Name: N-[[4-(4-ethylphenyl)-5-methyl-thiazol-2-yl]thiocarbamoyl]-2,6-dimethoxy-benzamide Formula: C22H23N3O3S2 MolecularWeight: 441.56632

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=C(SC(=N2)NC(=S)NC(=O)C3=C(C=CC=C3OC)OC)C

Isomeric SMILES

CCC1=CC=C(C=C1)C2=C(SC(=N2)NC(=S)NC(=O)C3=C(C=CC=C3OC)OC)C

InChI

InChI=1S/C22H23N3O3S2/c1-5-14-9-11-15(12-10-14)19-13(2)30-22(23-19)25-21(29)24-20(26)18-16(27-3)7-6-8-17(18)28-4/h6-12H,5H2,1-4H3,(H2,23,24,25,26,29)