ethyl 5-methyl-1-[4-[[4-(piperidin-1-ylmethyl)-1,3-thiazol-2-yl]carbamoyl]phenyl]pyrazole-4-carboxylate

Systemtic Name: ethyl 5-methyl-1-[4-[[4-(piperidin-1-ylmethyl)-1,3-thiazol-2-yl]carbamoyl]phenyl]pyrazole-4-carboxylate Openeye Name: ethyl 5-methyl-1-[4-[[4-(1-piperidylmethyl)thiazol-2-yl]carbamoyl]phenyl]pyrazole-4-carboxylate CAS Name: 5-methyl-1-[4-[oxo-[[4-(1-piperidinylmethyl)-2-thiazolyl]amino]methyl]phenyl]-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-methyl-1-[4-[[4-(piperidin-1-ylmethyl)-1,3-thiazol-2-yl]carbamoyl]phenyl]pyrazole-4-carboxylate Traditional Name: 5-methyl-1-[4-[[4-(piperidinomethyl)thiazol-2-yl]carbamoyl]phenyl]pyrazole-4-carboxylic acid ethyl ester Formula: C23H27N5O3S MolecularWeight: 453.55718

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)C(=O)NC3=NC(=CS3)CN4CCCCC4)C

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=CC=C(C=C2)C(=O)NC3=NC(=CS3)CN4CCCCC4)C

InChI

InChI=1S/C23H27N5O3S/c1-3-31-22(30)20-13-24-28(16(20)2)19-9-7-17(8-10-19)21(29)26-23-25-18(15-32-23)14-27-11-5-4-6-12-27/h7-10,13,15H,3-6,11-12,14H2,1-2H3,(H,25,26,29)