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

Systemtic Name: N-[[4-(3,4-dimethylphenyl)-1,3-thiazol-2-yl]carbamothioyl]-4-(phenylcarbonyl)benzamide Openeye Name: 4-benzoyl-N-[[4-(3,4-dimethylphenyl)thiazol-2-yl]carbamothioyl]benzamide CAS Name: 4-benzoyl-N-[[[4-(3,4-dimethylphenyl)-2-thiazolyl]amino]-sulfanylidenemethyl]benzamide IUPAC Name: 4-benzoyl-N-[[4-(3,4-dimethylphenyl)-1,3-thiazol-2-yl]carbamothioyl]benzamide Traditional Name: 4-benzoyl-N-[[4-(3,4-dimethylphenyl)thiazol-2-yl]thiocarbamoyl]benzamide Formula: C26H21N3O2S2 MolecularWeight: 471.59384

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=CSC(=N2)NC(=S)NC(=O)C3=CC=C(C=C3)C(=O)C4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=CSC(=N2)NC(=S)NC(=O)C3=CC=C(C=C3)C(=O)C4=CC=CC=C4)C

InChI

InChI=1S/C26H21N3O2S2/c1-16-8-9-21(14-17(16)2)22-15-33-26(27-22)29-25(32)28-24(31)20-12-10-19(11-13-20)23(30)18-6-4-3-5-7-18/h3-15H,1-2H3,(H2,27,28,29,31,32)