3-[3-(3-bromanyl-5-ethoxy-4-methoxy-phenyl)-1,2,4-oxadiazol-5-yl]-1-(4-methylpiperazin-1-yl)propan-1-one

Systemtic Name: 3-[3-(3-bromanyl-5-ethoxy-4-methoxy-phenyl)-1,2,4-oxadiazol-5-yl]-1-(4-methylpiperazin-1-yl)propan-1-one Openeye Name: 3-[3-(3-bromo-5-ethoxy-4-methoxy-phenyl)-1,2,4-oxadiazol-5-yl]-1-(4-methylpiperazin-1-yl)propan-1-one CAS Name: 3-[3-(3-bromo-5-ethoxy-4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-1-(4-methyl-1-piperazinyl)-1-propanone IUPAC Name: 3-[3-(3-bromo-5-ethoxy-4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-1-(4-methylpiperazin-1-yl)propan-1-one Traditional Name: 3-[3-(3-bromo-5-ethoxy-4-methoxy-phenyl)-1,2,4-oxadiazol-5-yl]-1-(4-methylpiperazino)propan-1-one Formula: C19H25BrN4O4 MolecularWeight: 453.3302

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C2=NOC(=N2)CCC(=O)N3CCN(CC3)C)Br)OC

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C2=NOC(=N2)CCC(=O)N3CCN(CC3)C)Br)OC

InChI

InChI=1S/C19H25BrN4O4/c1-4-27-15-12-13(11-14(20)18(15)26-3)19-21-16(28-22-19)5-6-17(25)24-9-7-23(2)8-10-24/h11-12H,4-10H2,1-3H3