4-[4-(5-bromanylpyrimidin-2-yl)piperazin-1-yl]carbonyl-5-methyl-2-pyrrol-1-yl-furan-3-carbonitrile

Systemtic Name: 4-[4-(5-bromanylpyrimidin-2-yl)piperazin-1-yl]carbonyl-5-methyl-2-pyrrol-1-yl-furan-3-carbonitrile Openeye Name: 4-[4-(5-bromopyrimidin-2-yl)piperazine-1-carbonyl]-5-methyl-2-pyrrol-1-yl-furan-3-carbonitrile CAS Name: 4-[[4-(5-bromo-2-pyrimidinyl)-1-piperazinyl]-oxomethyl]-5-methyl-2-(1-pyrrolyl)-3-furancarbonitrile IUPAC Name: 4-[4-(5-bromopyrimidin-2-yl)piperazine-1-carbonyl]-5-methyl-2-pyrrol-1-ylfuran-3-carbonitrile Traditional Name: 4-[4-(5-bromopyrimidin-2-yl)piperazine-1-carbonyl]-5-methyl-2-pyrrol-1-yl-3-furonitrile Formula: C19H17BrN6O2 MolecularWeight: 441.28128

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(O1)N2C=CC=C2)C#N)C(=O)N3CCN(CC3)C4=NC=C(C=N4)Br

Isomeric SMILES

CC1=C(C(=C(O1)N2C=CC=C2)C#N)C(=O)N3CCN(CC3)C4=NC=C(C=N4)Br

InChI

InChI=1S/C19H17BrN6O2/c1-13-16(15(10-21)18(28-13)25-4-2-3-5-25)17(27)24-6-8-26(9-7-24)19-22-11-14(20)12-23-19/h2-5,11-12H,6-9H2,1H3