5-methyl-4-[4-(6-methyl-2-propan-2-yl-pyrimidin-4-yl)piperazin-1-yl]carbonyl-2-pyrrol-1-yl-furan-3-carbonitrile

Systemtic Name: 5-methyl-4-[4-(6-methyl-2-propan-2-yl-pyrimidin-4-yl)piperazin-1-yl]carbonyl-2-pyrrol-1-yl-furan-3-carbonitrile Openeye Name: 4-[4-(2-isopropyl-6-methyl-pyrimidin-4-yl)piperazine-1-carbonyl]-5-methyl-2-pyrrol-1-yl-furan-3-carbonitrile CAS Name: 5-methyl-4-[[4-(6-methyl-2-propan-2-yl-4-pyrimidinyl)-1-piperazinyl]-oxomethyl]-2-(1-pyrrolyl)-3-furancarbonitrile IUPAC Name: 5-methyl-4-[4-(6-methyl-2-propan-2-ylpyrimidin-4-yl)piperazine-1-carbonyl]-2-pyrrol-1-ylfuran-3-carbonitrile Traditional Name: 4-[4-(2-isopropyl-6-methyl-pyrimidin-4-yl)piperazine-1-carbonyl]-5-methyl-2-pyrrol-1-yl-3-furonitrile Formula: C23H26N6O2 MolecularWeight: 418.49154

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)C(C)C)N2CCN(CC2)C(=O)C3=C(OC(=C3C#N)N4C=CC=C4)C

Isomeric SMILES

CC1=CC(=NC(=N1)C(C)C)N2CCN(CC2)C(=O)C3=C(OC(=C3C#N)N4C=CC=C4)C

InChI

InChI=1S/C23H26N6O2/c1-15(2)21-25-16(3)13-19(26-21)27-9-11-28(12-10-27)22(30)20-17(4)31-23(18(20)14-24)29-7-5-6-8-29/h5-8,13,15H,9-12H2,1-4H3