[5-cyclopropyl-1-[4-(3-methoxyphenyl)pyrimidin-2-yl]pyrazol-4-yl]-(4-ethylpiperazin-4-ium-1-yl)methanone

Systemtic Name: [5-cyclopropyl-1-[4-(3-methoxyphenyl)pyrimidin-2-yl]pyrazol-4-yl]-(4-ethylpiperazin-4-ium-1-yl)methanone Openeye Name: [5-cyclopropyl-1-[4-(3-methoxyphenyl)pyrimidin-2-yl]pyrazol-4-yl]-(4-ethylpiperazin-4-ium-1-yl)methanone CAS Name: [5-cyclopropyl-1-[4-(3-methoxyphenyl)-2-pyrimidinyl]-4-pyrazolyl]-(4-ethyl-1-piperazin-4-iumyl)methanone IUPAC Name: [5-cyclopropyl-1-[4-(3-methoxyphenyl)pyrimidin-2-yl]pyrazol-4-yl]-(4-ethylpiperazin-4-ium-1-yl)methanone Traditional Name: [5-cyclopropyl-1-[4-(3-methoxyphenyl)pyrimidin-2-yl]pyrazol-4-yl]-(4-ethylpiperazin-4-ium-1-yl)methanone Formula: C24H29N6O2+ MolecularWeight: 433.52606

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C(=O)C2=C(N(N=C2)C3=NC=CC(=N3)C4=CC(=CC=C4)OC)C5CC5

Isomeric SMILES

CC[NH+]1CCN(CC1)C(=O)C2=C(N(N=C2)C3=NC=CC(=N3)C4=CC(=CC=C4)OC)C5CC5

InChI

InChI=1S/C24H28N6O2/c1-3-28-11-13-29(14-12-28)23(31)20-16-26-30(22(20)17-7-8-17)24-25-10-9-21(27-24)18-5-4-6-19(15-18)32-2/h4-6,9-10,15-17H,3,7-8,11-14H2,1-2H3/p+1