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

Systemtic Name: N-[[4-(4-ethylphenyl)-5-methyl-1,3-thiazol-2-yl]carbamothioyl]-2-methyl-benzamide Openeye Name: N-[[4-(4-ethylphenyl)-5-methyl-thiazol-2-yl]carbamothioyl]-2-methyl-benzamide CAS Name: N-[[[4-(4-ethylphenyl)-5-methyl-2-thiazolyl]amino]-sulfanylidenemethyl]-2-methylbenzamide IUPAC Name: N-[[4-(4-ethylphenyl)-5-methyl-1,3-thiazol-2-yl]carbamothioyl]-2-methylbenzamide Traditional Name: N-[[4-(4-ethylphenyl)-5-methyl-thiazol-2-yl]thiocarbamoyl]-2-methyl-benzamide Formula: C21H21N3OS2 MolecularWeight: 395.54094

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=C(SC(=N2)NC(=S)NC(=O)C3=CC=CC=C3C)C

Isomeric SMILES

CCC1=CC=C(C=C1)C2=C(SC(=N2)NC(=S)NC(=O)C3=CC=CC=C3C)C

InChI

InChI=1S/C21H21N3OS2/c1-4-15-9-11-16(12-10-15)18-14(3)27-21(22-18)24-20(26)23-19(25)17-8-6-5-7-13(17)2/h5-12H,4H2,1-3H3,(H2,22,23,24,25,26)