ethyl 1-[[2-(dimethylamino)-1,3-thiazol-5-yl]methyl]-3-(phenylmethyl)piperidine-3-carboxylate

Systemtic Name: ethyl 1-[[2-(dimethylamino)-1,3-thiazol-5-yl]methyl]-3-(phenylmethyl)piperidine-3-carboxylate Openeye Name: ethyl 3-benzyl-1-[[2-(dimethylamino)thiazol-5-yl]methyl]piperidine-3-carboxylate CAS Name: 1-[[2-(dimethylamino)-5-thiazolyl]methyl]-3-(phenylmethyl)-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-benzyl-1-[[2-(dimethylamino)-1,3-thiazol-5-yl]methyl]piperidine-3-carboxylate Traditional Name: 3-benzyl-1-[[2-(dimethylamino)thiazol-5-yl]methyl]nipecotic acid ethyl ester Formula: C21H29N3O2S MolecularWeight: 387.53886

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCCN(C1)CC2=CN=C(S2)N(C)C)CC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1(CCCN(C1)CC2=CN=C(S2)N(C)C)CC3=CC=CC=C3

InChI

InChI=1S/C21H29N3O2S/c1-4-26-19(25)21(13-17-9-6-5-7-10-17)11-8-12-24(16-21)15-18-14-22-20(27-18)23(2)3/h5-7,9-10,14H,4,8,11-13,15-16H2,1-3H3