methyl 2-azanyl-4-[4-(phenylmethyl)piperidin-1-yl]-1,3-thiazole-5-carboxylate

Systemtic Name: methyl 2-azanyl-4-[4-(phenylmethyl)piperidin-1-yl]-1,3-thiazole-5-carboxylate Openeye Name: methyl 2-amino-4-(4-benzyl-1-piperidyl)thiazole-5-carboxylate CAS Name: 2-amino-4-[4-(phenylmethyl)-1-piperidinyl]-5-thiazolecarboxylic acid methyl ester IUPAC Name: methyl 2-amino-4-(4-benzylpiperidin-1-yl)-1,3-thiazole-5-carboxylate Traditional Name: 2-amino-4-(4-benzylpiperidino)thiazole-5-carboxylic acid methyl ester Formula: C17H21N3O2S MolecularWeight: 331.43254

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(N=C(S1)N)N2CCC(CC2)CC3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=C(N=C(S1)N)N2CCC(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C17H21N3O2S/c1-22-16(21)14-15(19-17(18)23-14)20-9-7-13(8-10-20)11-12-5-3-2-4-6-12/h2-6,13H,7-11H2,1H3,(H2,18,19)