3-(2-bromanyl-4,5-dimethoxy-phenyl)-N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)propanamide

Systemtic Name: 3-(2-bromanyl-4,5-dimethoxy-phenyl)-N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)propanamide Openeye Name: 3-(2-bromo-4,5-dimethoxy-phenyl)-N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)propanamide CAS Name: 3-(2-bromo-4,5-dimethoxyphenyl)-N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)propanamide IUPAC Name: 3-(2-bromo-4,5-dimethoxyphenyl)-N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)propanamide Traditional Name: 3-(2-bromo-4,5-dimethoxy-phenyl)-N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)propionamide Formula: C16H18BrN3O3S MolecularWeight: 412.30142

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)CCC(=O)NC2=NN=C(S2)C3CC3)Br)OC

Isomeric SMILES

COC1=C(C=C(C(=C1)CCC(=O)NC2=NN=C(S2)C3CC3)Br)OC

InChI

InChI=1S/C16H18BrN3O3S/c1-22-12-7-10(11(17)8-13(12)23-2)5-6-14(21)18-16-20-19-15(24-16)9-3-4-9/h7-9H,3-6H2,1-2H3,(H,18,20,21)