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

Systemtic Name: 3-(2-bromanyl-4,5-dimethoxy-phenyl)-N-(5-propylsulfanyl-1,3,4-thiadiazol-2-yl)propanamide Openeye Name: 3-(2-bromo-4,5-dimethoxy-phenyl)-N-(5-propylsulfanyl-1,3,4-thiadiazol-2-yl)propanamide CAS Name: 3-(2-bromo-4,5-dimethoxyphenyl)-N-[5-(propylthio)-1,3,4-thiadiazol-2-yl]propanamide IUPAC Name: 3-(2-bromo-4,5-dimethoxyphenyl)-N-(5-propylsulfanyl-1,3,4-thiadiazol-2-yl)propanamide Traditional Name: 3-(2-bromo-4,5-dimethoxy-phenyl)-N-[5-(propylthio)-1,3,4-thiadiazol-2-yl]propionamide Formula: C16H20BrN3O3S2 MolecularWeight: 446.3823

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=NN=C(S1)NC(=O)CCC2=CC(=C(C=C2Br)OC)OC

Isomeric SMILES

CCCSC1=NN=C(S1)NC(=O)CCC2=CC(=C(C=C2Br)OC)OC

InChI

InChI=1S/C16H20BrN3O3S2/c1-4-7-24-16-20-19-15(25-16)18-14(21)6-5-10-8-12(22-2)13(23-3)9-11(10)17/h8-9H,4-7H2,1-3H3,(H,18,19,21)