2-chloranyl-N-[[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]carbamothioyl]-5-iodanyl-benzamide

Systemtic Name: 2-chloranyl-N-[[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]carbamothioyl]-5-iodanyl-benzamide Openeye Name: 2-chloro-N-[[4-(3,4-dimethoxyphenyl)thiazol-2-yl]carbamothioyl]-5-iodo-benzamide CAS Name: 2-chloro-N-[[[4-(3,4-dimethoxyphenyl)-2-thiazolyl]amino]-sulfanylidenemethyl]-5-iodobenzamide IUPAC Name: 2-chloro-N-[[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]carbamothioyl]-5-iodobenzamide Traditional Name: 2-chloro-N-[[4-(3,4-dimethoxyphenyl)thiazol-2-yl]thiocarbamoyl]-5-iodo-benzamide Formula: C19H15ClIN3O3S2 MolecularWeight: 559.82817

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CSC(=N2)NC(=S)NC(=O)C3=C(C=CC(=C3)I)Cl)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CSC(=N2)NC(=S)NC(=O)C3=C(C=CC(=C3)I)Cl)OC

InChI

InChI=1S/C19H15ClIN3O3S2/c1-26-15-6-3-10(7-16(15)27-2)14-9-29-19(22-14)24-18(28)23-17(25)12-8-11(21)4-5-13(12)20/h3-9H,1-2H3,(H2,22,23,24,25,28)