tert-butyl 4-[4-[(pyridin-4-ylcarbonylamino)carbamoyl]-1,3-thiazol-2-yl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[4-[(pyridin-4-ylcarbonylamino)carbamoyl]-1,3-thiazol-2-yl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[4-[(pyridine-4-carbonylamino)carbamoyl]thiazol-2-yl]piperidine-1-carboxylate CAS Name: 4-[4-[oxo-[[oxo(pyridin-4-yl)methyl]hydrazo]methyl]-2-thiazolyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-[(pyridine-4-carbonylamino)carbamoyl]-1,3-thiazol-2-yl]piperidine-1-carboxylate Traditional Name: 4-[4-(isonicotinamidocarbamoyl)thiazol-2-yl]piperidine-1-carboxylic acid tert-butyl ester Formula: C20H25N5O4S MolecularWeight: 431.5086

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)C2=NC(=CS2)C(=O)NNC(=O)C3=CC=NC=C3

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)C2=NC(=CS2)C(=O)NNC(=O)C3=CC=NC=C3

InChI

InChI=1S/C20H25N5O4S/c1-20(2,3)29-19(28)25-10-6-14(7-11-25)18-22-15(12-30-18)17(27)24-23-16(26)13-4-8-21-9-5-13/h4-5,8-9,12,14H,6-7,10-11H2,1-3H3,(H,23,26)(H,24,27)