2-[[5-cyclopropyl-1-[4-(5-methylfuran-2-yl)pyrimidin-2-yl]pyrazol-4-yl]carbonyl-methyl-amino]ethyl-dimethyl-azanium

Systemtic Name: 2-[[5-cyclopropyl-1-[4-(5-methylfuran-2-yl)pyrimidin-2-yl]pyrazol-4-yl]carbonyl-methyl-amino]ethyl-dimethyl-azanium Openeye Name: 2-[[5-cyclopropyl-1-[4-(5-methyl-2-furyl)pyrimidin-2-yl]pyrazole-4-carbonyl]-methyl-amino]ethyl-dimethyl-ammonium CAS Name: 2-[[[5-cyclopropyl-1-[4-(5-methyl-2-furanyl)-2-pyrimidinyl]-4-pyrazolyl]-oxomethyl]-methylamino]ethyl-dimethylammonium IUPAC Name: 2-[[5-cyclopropyl-1-[4-(5-methylfuran-2-yl)pyrimidin-2-yl]pyrazole-4-carbonyl]-methylamino]ethyl-dimethylazanium Traditional Name: 2-[[5-cyclopropyl-1-[4-(5-methyl-2-furyl)pyrimidin-2-yl]pyrazole-4-carbonyl]-methyl-amino]ethyl-dimethyl-ammonium Formula: C21H27N6O2+ MolecularWeight: 395.47808

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C2=NC(=NC=C2)N3C(=C(C=N3)C(=O)N(C)CC[NH+](C)C)C4CC4

Isomeric SMILES

CC1=CC=C(O1)C2=NC(=NC=C2)N3C(=C(C=N3)C(=O)N(C)CC[NH+](C)C)C4CC4

InChI

InChI=1S/C21H26N6O2/c1-14-5-8-18(29-14)17-9-10-22-21(24-17)27-19(15-6-7-15)16(13-23-27)20(28)26(4)12-11-25(2)3/h5,8-10,13,15H,6-7,11-12H2,1-4H3/p+1