2-[[6-[(2-pyridin-4-yl-1,3-thiazol-4-yl)carbamoylamino]pyridin-2-yl]methyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 2-[[6-[(2-pyridin-4-yl-1,3-thiazol-4-yl)carbamoylamino]pyridin-2-yl]methyl]pyrrolidine-2-carboxylic acid Openeye Name: 2-[[6-[[2-(4-pyridyl)thiazol-4-yl]carbamoylamino]-2-pyridyl]methyl]pyrrolidine-2-carboxylic acid CAS Name: 2-[[6-[[oxo-[(2-pyridin-4-yl-4-thiazolyl)amino]methyl]amino]-2-pyridinyl]methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 2-[[6-[(2-pyridin-4-yl-1,3-thiazol-4-yl)carbamoylamino]pyridin-2-yl]methyl]pyrrolidine-2-carboxylic acid Traditional Name: 2-[[6-[[2-(4-pyridyl)thiazol-4-yl]carbamoylamino]-2-pyridyl]methyl]proline Formula: C20H20N6O3S MolecularWeight: 424.4762

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(NC1)(CC2=NC(=CC=C2)NC(=O)NC3=CSC(=N3)C4=CC=NC=C4)C(=O)O

Isomeric SMILES

C1CC(NC1)(CC2=NC(=CC=C2)NC(=O)NC3=CSC(=N3)C4=CC=NC=C4)C(=O)O

InChI

InChI=1S/C20H20N6O3S/c27-18(28)20(7-2-8-22-20)11-14-3-1-4-15(23-14)25-19(29)26-16-12-30-17(24-16)13-5-9-21-10-6-13/h1,3-6,9-10,12,22H,2,7-8,11H2,(H,27,28)(H2,23,25,26,29)