[5-cyclopropyl-1-[4-(5-methylfuran-2-yl)pyrimidin-2-yl]pyrazol-4-yl]-(4-propan-2-ylpiperazin-4-ium-1-yl)methanone

Systemtic Name: [5-cyclopropyl-1-[4-(5-methylfuran-2-yl)pyrimidin-2-yl]pyrazol-4-yl]-(4-propan-2-ylpiperazin-4-ium-1-yl)methanone Openeye Name: [5-cyclopropyl-1-[4-(5-methyl-2-furyl)pyrimidin-2-yl]pyrazol-4-yl]-(4-isopropylpiperazin-4-ium-1-yl)methanone CAS Name: [5-cyclopropyl-1-[4-(5-methyl-2-furanyl)-2-pyrimidinyl]-4-pyrazolyl]-(4-propan-2-yl-1-piperazin-4-iumyl)methanone IUPAC Name: [5-cyclopropyl-1-[4-(5-methylfuran-2-yl)pyrimidin-2-yl]pyrazol-4-yl]-(4-propan-2-ylpiperazin-4-ium-1-yl)methanone Traditional Name: [5-cyclopropyl-1-[4-(5-methyl-2-furyl)pyrimidin-2-yl]pyrazol-4-yl]-(4-isopropylpiperazin-4-ium-1-yl)methanone Formula: C23H29N6O2+ MolecularWeight: 421.51536

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C2=NC(=NC=C2)N3C(=C(C=N3)C(=O)N4CC[NH+](CC4)C(C)C)C5CC5

Isomeric SMILES

CC1=CC=C(O1)C2=NC(=NC=C2)N3C(=C(C=N3)C(=O)N4CC[NH+](CC4)C(C)C)C5CC5

InChI

InChI=1S/C23H28N6O2/c1-15(2)27-10-12-28(13-11-27)22(30)18-14-25-29(21(18)17-5-6-17)23-24-9-8-19(26-23)20-7-4-16(3)31-20/h4,7-9,14-15,17H,5-6,10-13H2,1-3H3/p+1