tert-butyl 3-[[2-[(5-chloranylpyridin-2-yl)carbamoyl]phenyl]carbamoylamino]pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl 3-[[2-[(5-chloranylpyridin-2-yl)carbamoyl]phenyl]carbamoylamino]pyrrolidine-1-carboxylate Openeye Name: tert-butyl 3-[[2-[(5-chloro-2-pyridyl)carbamoyl]phenyl]carbamoylamino]pyrrolidine-1-carboxylate CAS Name: 3-[[[2-[[(5-chloro-2-pyridinyl)amino]-oxomethyl]anilino]-oxomethyl]amino]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[[2-[(5-chloropyridin-2-yl)carbamoyl]phenyl]carbamoylamino]pyrrolidine-1-carboxylate Traditional Name: 3-[[2-[(5-chloro-2-pyridyl)carbamoyl]phenyl]carbamoylamino]pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C22H26ClN5O4 MolecularWeight: 459.92594

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(C1)NC(=O)NC2=CC=CC=C2C(=O)NC3=NC=C(C=C3)Cl

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(C1)NC(=O)NC2=CC=CC=C2C(=O)NC3=NC=C(C=C3)Cl

InChI

InChI=1S/C22H26ClN5O4/c1-22(2,3)32-21(31)28-11-10-15(13-28)25-20(30)26-17-7-5-4-6-16(17)19(29)27-18-9-8-14(23)12-24-18/h4-9,12,15H,10-11,13H2,1-3H3,(H,24,27,29)(H2,25,26,30)