tert-butyl 4-[(6-chloranylpyridazin-3-yl)amino]-2-cyano-2-pyrrolidin-2-ylcarbonyl-pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl 4-[(6-chloranylpyridazin-3-yl)amino]-2-cyano-2-pyrrolidin-2-ylcarbonyl-pyrrolidine-1-carboxylate Openeye Name: tert-butyl 4-[(6-chloropyridazin-3-yl)amino]-2-cyano-2-(pyrrolidine-2-carbonyl)pyrrolidine-1-carboxylate CAS Name: 4-[(6-chloro-3-pyridazinyl)amino]-2-cyano-2-[oxo(2-pyrrolidinyl)methyl]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(6-chloropyridazin-3-yl)amino]-2-cyano-2-(pyrrolidine-2-carbonyl)pyrrolidine-1-carboxylate Traditional Name: 4-[(6-chloropyridazin-3-yl)amino]-2-cyano-2-prolyl-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(CC1(C#N)C(=O)C2CCCN2)NC3=NN=C(C=C3)Cl

Isomeric SMILES

CC(C)(C)OC(=O)N1CC(CC1(C#N)C(=O)C2CCCN2)NC3=NN=C(C=C3)Cl

InChI

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