N-[5-[(4-methylphenyl)methyl]-1,3-thiazol-2-yl]-1-pyrimidin-2-yl-piperidine-4-carboxamide

Systemtic Name: N-[5-[(4-methylphenyl)methyl]-1,3-thiazol-2-yl]-1-pyrimidin-2-yl-piperidine-4-carboxamide Openeye Name: N-[5-(p-tolylmethyl)thiazol-2-yl]-1-pyrimidin-2-yl-piperidine-4-carboxamide CAS Name: N-[5-[(4-methylphenyl)methyl]-2-thiazolyl]-1-(2-pyrimidinyl)-4-piperidinecarboxamide IUPAC Name: N-[5-[(4-methylphenyl)methyl]-1,3-thiazol-2-yl]-1-pyrimidin-2-ylpiperidine-4-carboxamide Traditional Name: N-[5-(4-methylbenzyl)thiazol-2-yl]-1-(2-pyrimidyl)isonipecotamide Formula: C21H23N5OS MolecularWeight: 393.50522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CC2=CN=C(S2)NC(=O)C3CCN(CC3)C4=NC=CC=N4

Isomeric SMILES

CC1=CC=C(C=C1)CC2=CN=C(S2)NC(=O)C3CCN(CC3)C4=NC=CC=N4

InChI

InChI=1S/C21H23N5OS/c1-15-3-5-16(6-4-15)13-18-14-24-21(28-18)25-19(27)17-7-11-26(12-8-17)20-22-9-2-10-23-20/h2-6,9-10,14,17H,7-8,11-13H2,1H3,(H,24,25,27)