5-[4-(3-bromanyl-4-methoxy-phenyl)carbonylpiperazin-1-yl]-2-cyclopropyl-1,3-oxazole-4-carbonitrile

Systemtic Name: 5-[4-(3-bromanyl-4-methoxy-phenyl)carbonylpiperazin-1-yl]-2-cyclopropyl-1,3-oxazole-4-carbonitrile Openeye Name: 5-[4-(3-bromo-4-methoxy-benzoyl)piperazin-1-yl]-2-cyclopropyl-oxazole-4-carbonitrile CAS Name: 5-[4-[(3-bromo-4-methoxyphenyl)-oxomethyl]-1-piperazinyl]-2-cyclopropyl-4-oxazolecarbonitrile IUPAC Name: 5-[4-(3-bromo-4-methoxybenzoyl)piperazin-1-yl]-2-cyclopropyl-1,3-oxazole-4-carbonitrile Traditional Name: 5-[4-(3-bromo-4-methoxy-benzoyl)piperazino]-2-cyclopropyl-oxazole-4-carbonitrile Formula: C19H19BrN4O3 MolecularWeight: 431.28316

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C3=C(N=C(O3)C4CC4)C#N)Br

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)N2CCN(CC2)C3=C(N=C(O3)C4CC4)C#N)Br

InChI

InChI=1S/C19H19BrN4O3/c1-26-16-5-4-13(10-14(16)20)18(25)23-6-8-24(9-7-23)19-15(11-21)22-17(27-19)12-2-3-12/h4-5,10,12H,2-3,6-9H2,1H3