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

Systemtic Name: 4-[[6-[(2-pyridin-4-yl-1,3-thiazol-4-yl)carbamoylamino]pyridin-2-yl]oxymethyl]piperidine-1-carboxylic acid Openeye Name: 4-[[6-[[2-(4-pyridyl)thiazol-4-yl]carbamoylamino]-2-pyridyl]oxymethyl]piperidine-1-carboxylic acid CAS Name: 4-[[6-[[oxo-[(2-pyridin-4-yl-4-thiazolyl)amino]methyl]amino]-2-pyridinyl]oxymethyl]-1-piperidinecarboxylic acid IUPAC Name: 4-[[6-[(2-pyridin-4-yl-1,3-thiazol-4-yl)carbamoylamino]pyridin-2-yl]oxymethyl]piperidine-1-carboxylic acid Traditional Name: 4-[[6-[[2-(4-pyridyl)thiazol-4-yl]carbamoylamino]-2-pyridyl]oxymethyl]piperidine-1-carboxylic acid Formula: C21H22N6O4S MolecularWeight: 454.50218

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1COC2=CC=CC(=N2)NC(=O)NC3=CSC(=N3)C4=CC=NC=C4)C(=O)O

Isomeric SMILES

C1CN(CCC1COC2=CC=CC(=N2)NC(=O)NC3=CSC(=N3)C4=CC=NC=C4)C(=O)O

InChI

InChI=1S/C21H22N6O4S/c28-20(26-17-13-32-19(24-17)15-4-8-22-9-5-15)25-16-2-1-3-18(23-16)31-12-14-6-10-27(11-7-14)21(29)30/h1-5,8-9,13-14H,6-7,10-12H2,(H,29,30)(H2,23,25,26,28)