tert-butyl 4-[(6-chloranylpyridazin-3-yl)amino]-2-(2-cyanopyrrolidin-1-yl)carbonyl-pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl 4-[(6-chloranylpyridazin-3-yl)amino]-2-(2-cyanopyrrolidin-1-yl)carbonyl-pyrrolidine-1-carboxylate Openeye Name: tert-butyl 4-[(6-chloropyridazin-3-yl)amino]-2-(2-cyanopyrrolidine-1-carbonyl)pyrrolidine-1-carboxylate CAS Name: 4-[(6-chloro-3-pyridazinyl)amino]-2-[(2-cyano-1-pyrrolidinyl)-oxomethyl]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(6-chloropyridazin-3-yl)amino]-2-(2-cyanopyrrolidine-1-carbonyl)pyrrolidine-1-carboxylate Traditional Name: 4-[(6-chloropyridazin-3-yl)amino]-2-(2-cyanopyrrolidine-1-carbonyl)pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C19H25ClN6O3 MolecularWeight: 420.8932

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CC(CC1C(=O)N2CCCC2C#N)NC3=NN=C(C=C3)Cl

Isomeric SMILES

CC(C)(C)OC(=O)N1CC(CC1C(=O)N2CCCC2C#N)NC3=NN=C(C=C3)Cl

InChI

InChI=1S/C19H25ClN6O3/c1-19(2,3)29-18(28)26-11-12(22-16-7-6-15(20)23-24-16)9-14(26)17(27)25-8-4-5-13(25)10-21/h6-7,12-14H,4-5,8-9,11H2,1-3H3,(H,22,24)