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

Systemtic Name: 2-[[[6-[(2-pyridin-4-yl-1,3-thiazol-4-yl)carbamoylamino]pyridin-2-yl]amino]methyl]piperidine-1-carboxylic acid Openeye Name: 2-[[[6-[[2-(4-pyridyl)thiazol-4-yl]carbamoylamino]-2-pyridyl]amino]methyl]piperidine-1-carboxylic acid CAS Name: 2-[[[6-[[oxo-[(2-pyridin-4-yl-4-thiazolyl)amino]methyl]amino]-2-pyridinyl]amino]methyl]-1-piperidinecarboxylic acid IUPAC Name: 2-[[[6-[(2-pyridin-4-yl-1,3-thiazol-4-yl)carbamoylamino]pyridin-2-yl]amino]methyl]piperidine-1-carboxylic acid Traditional Name: 2-[[[6-[[2-(4-pyridyl)thiazol-4-yl]carbamoylamino]-2-pyridyl]amino]methyl]piperidine-1-carboxylic acid Formula: C21H23N7O3S MolecularWeight: 453.51742

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)CNC2=CC=CC(=N2)NC(=O)NC3=CSC(=N3)C4=CC=NC=C4)C(=O)O

Isomeric SMILES

C1CCN(C(C1)CNC2=CC=CC(=N2)NC(=O)NC3=CSC(=N3)C4=CC=NC=C4)C(=O)O

InChI

InChI=1S/C21H23N7O3S/c29-20(27-18-13-32-19(25-18)14-7-9-22-10-8-14)26-17-6-3-5-16(24-17)23-12-15-4-1-2-11-28(15)21(30)31/h3,5-10,13,15H,1-2,4,11-12H2,(H,30,31)(H3,23,24,26,27,29)