N-[2-(2-bromanyl-4,5-dimethoxy-phenyl)ethyl]-3-phenyl-2-sulfanylidene-1H-imidazole-4-carboxamide

Systemtic Name: N-[2-(2-bromanyl-4,5-dimethoxy-phenyl)ethyl]-3-phenyl-2-sulfanylidene-1H-imidazole-4-carboxamide Openeye Name: N-[2-(2-bromo-4,5-dimethoxy-phenyl)ethyl]-3-phenyl-2-thioxo-1H-imidazole-4-carboxamide CAS Name: N-[2-(2-bromo-4,5-dimethoxyphenyl)ethyl]-3-phenyl-2-sulfanylidene-1H-imidazole-4-carboxamide IUPAC Name: N-[2-(2-bromo-4,5-dimethoxyphenyl)ethyl]-3-phenyl-2-sulfanylidene-1H-imidazole-4-carboxamide Traditional Name: N-[2-(2-bromo-4,5-dimethoxy-phenyl)ethyl]-3-phenyl-2-thioxo-4-imidazoline-4-carboxamide Formula: C20H20BrN3O3S MolecularWeight: 462.3601

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)CCNC(=O)C2=CNC(=S)N2C3=CC=CC=C3)Br)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)CCNC(=O)C2=CNC(=S)N2C3=CC=CC=C3)Br)OC

InChI

InChI=1S/C20H20BrN3O3S/c1-26-17-10-13(15(21)11-18(17)27-2)8-9-22-19(25)16-12-23-20(28)24(16)14-6-4-3-5-7-14/h3-7,10-12H,8-9H2,1-2H3,(H,22,25)(H,23,28)