tert-butyl-[4-[[1-(phenylmethyl)piperidin-4-yl]carbamoyl]-1,3-thiazol-2-yl]carbamic acid

Systemtic Name: tert-butyl-[4-[[1-(phenylmethyl)piperidin-4-yl]carbamoyl]-1,3-thiazol-2-yl]carbamic acid Openeye Name: [4-[(1-benzyl-4-piperidyl)carbamoyl]thiazol-2-yl]-tert-butyl-carbamic acid CAS Name: tert-butyl-[4-[oxo-[[1-(phenylmethyl)-4-piperidinyl]amino]methyl]-2-thiazolyl]carbamic acid IUPAC Name: [4-[(1-benzylpiperidin-4-yl)carbamoyl]-1,3-thiazol-2-yl]-tert-butylcarbamic acid Traditional Name: [4-[(1-benzyl-4-piperidyl)carbamoyl]thiazol-2-yl]-tert-butyl-carbamic acid Formula: C21H28N4O3S MolecularWeight: 416.53702

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N(C1=NC(=CS1)C(=O)NC2CCN(CC2)CC3=CC=CC=C3)C(=O)O

Isomeric SMILES

CC(C)(C)N(C1=NC(=CS1)C(=O)NC2CCN(CC2)CC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C21H28N4O3S/c1-21(2,3)25(20(27)28)19-23-17(14-29-19)18(26)22-16-9-11-24(12-10-16)13-15-7-5-4-6-8-15/h4-8,14,16H,9-13H2,1-3H3,(H,22,26)(H,27,28)