ethyl 5-[(1-oxidanylpropan-2-ylamino)methyl]-1-(4-phenyl-1,3-thiazol-2-yl)pyrazole-4-carboxylate

Systemtic Name: ethyl 5-[(1-oxidanylpropan-2-ylamino)methyl]-1-(4-phenyl-1,3-thiazol-2-yl)pyrazole-4-carboxylate Openeye Name: ethyl 5-[[(2-hydroxy-1-methyl-ethyl)amino]methyl]-1-(4-phenylthiazol-2-yl)pyrazole-4-carboxylate CAS Name: 5-[(1-hydroxypropan-2-ylamino)methyl]-1-(4-phenyl-2-thiazolyl)-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[(1-hydroxypropan-2-ylamino)methyl]-1-(4-phenyl-1,3-thiazol-2-yl)pyrazole-4-carboxylate Traditional Name: 5-[[(2-hydroxy-1-methyl-ethyl)amino]methyl]-1-(4-phenylthiazol-2-yl)pyrazole-4-carboxylic acid ethyl ester Formula: C19H22N4O3S MolecularWeight: 386.46798

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=NC(=CS2)C3=CC=CC=C3)CNC(C)CO

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=NC(=CS2)C3=CC=CC=C3)CNC(C)CO

InChI

InChI=1S/C19H22N4O3S/c1-3-26-18(25)15-9-21-23(17(15)10-20-13(2)11-24)19-22-16(12-27-19)14-7-5-4-6-8-14/h4-9,12-13,20,24H,3,10-11H2,1-2H3