2-[1-(4-bromophenyl)imidazol-2-yl]sulfanyl-N-(4,6-dimethoxypyrimidin-2-yl)ethanamide

Systemtic Name: 2-[1-(4-bromophenyl)imidazol-2-yl]sulfanyl-N-(4,6-dimethoxypyrimidin-2-yl)ethanamide Openeye Name: 2-[1-(4-bromophenyl)imidazol-2-yl]sulfanyl-N-(4,6-dimethoxypyrimidin-2-yl)acetamide CAS Name: 2-[[1-(4-bromophenyl)-2-imidazolyl]thio]-N-(4,6-dimethoxy-2-pyrimidinyl)acetamide IUPAC Name: 2-[1-(4-bromophenyl)imidazol-2-yl]sulfanyl-N-(4,6-dimethoxypyrimidin-2-yl)acetamide Traditional Name: 2-[[1-(4-bromophenyl)imidazol-2-yl]thio]-N-(4,6-dimethoxypyrimidin-2-yl)acetamide Formula: C17H16BrN5O3S MolecularWeight: 450.30964

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC(=N1)NC(=O)CSC2=NC=CN2C3=CC=C(C=C3)Br)OC

Isomeric SMILES

COC1=CC(=NC(=N1)NC(=O)CSC2=NC=CN2C3=CC=C(C=C3)Br)OC

InChI

InChI=1S/C17H16BrN5O3S/c1-25-14-9-15(26-2)22-16(21-14)20-13(24)10-27-17-19-7-8-23(17)12-5-3-11(18)4-6-12/h3-9H,10H2,1-2H3,(H,20,21,22,24)