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

Systemtic Name: 5-bromanyl-N-[[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]carbamothioyl]-2-methoxy-benzamide Openeye Name: 5-bromo-N-[[4-(3,4-dimethoxyphenyl)thiazol-2-yl]carbamothioyl]-2-methoxy-benzamide CAS Name: 5-bromo-N-[[[4-(3,4-dimethoxyphenyl)-2-thiazolyl]amino]-sulfanylidenemethyl]-2-methoxybenzamide IUPAC Name: 5-bromo-N-[[4-(3,4-dimethoxyphenyl)-1,3-thiazol-2-yl]carbamothioyl]-2-methoxybenzamide Traditional Name: 5-bromo-N-[[4-(3,4-dimethoxyphenyl)thiazol-2-yl]thiocarbamoyl]-2-methoxy-benzamide Formula: C20H18BrN3O4S2 MolecularWeight: 508.40862

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)C(=O)NC(=S)NC2=NC(=CS2)C3=CC(=C(C=C3)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)Br)C(=O)NC(=S)NC2=NC(=CS2)C3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C20H18BrN3O4S2/c1-26-15-7-5-12(21)9-13(15)18(25)23-19(29)24-20-22-14(10-30-20)11-4-6-16(27-2)17(8-11)28-3/h4-10H,1-3H3,(H2,22,23,24,25,29)