N-[(1-ethylpyrrolidin-1-ium-2-yl)methyl]-2-(4-methyl-2-oxidanylidene-pyrimido[1,2-b]indazol-6-yl)propanamide

Systemtic Name: N-[(1-ethylpyrrolidin-1-ium-2-yl)methyl]-2-(4-methyl-2-oxidanylidene-pyrimido[1,2-b]indazol-6-yl)propanamide Openeye Name: N-[(1-ethylpyrrolidin-1-ium-2-yl)methyl]-2-(4-methyl-2-oxo-pyrimido[1,2-b]indazol-6-yl)propanamide CAS Name: N-[(1-ethyl-2-pyrrolidin-1-iumyl)methyl]-2-(4-methyl-2-oxo-6-pyrimido[1,2-b]indazolyl)propanamide IUPAC Name: N-[(1-ethylpyrrolidin-1-ium-2-yl)methyl]-2-(4-methyl-2-oxopyrimido[1,2-b]indazol-6-yl)propanamide Traditional Name: N-[(1-ethylpyrrolidin-1-ium-2-yl)methyl]-2-(2-keto-4-methyl-pyrimid[1,2-b]indazol-6-yl)propionamide Formula: C21H28N5O2+ MolecularWeight: 382.47932

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCCC1CNC(=O)C(C)N2C3=CC=CC=C3C4=NC(=O)C=C(N42)C

Isomeric SMILES

CC[NH+]1CCCC1CNC(=O)C(C)N2C3=CC=CC=C3C4=NC(=O)C=C(N42)C

InChI

InChI=1S/C21H27N5O2/c1-4-24-11-7-8-16(24)13-22-21(28)15(3)26-18-10-6-5-9-17(18)20-23-19(27)12-14(2)25(20)26/h5-6,9-10,12,15-16H,4,7-8,11,13H2,1-3H3,(H,22,28)/p+1