ethyl (3S)-1-[[2-[(3-methylphenyl)amino]-1,3-thiazol-4-yl]carbonyl]piperidine-3-carboxylate

Systemtic Name: ethyl (3S)-1-[[2-[(3-methylphenyl)amino]-1,3-thiazol-4-yl]carbonyl]piperidine-3-carboxylate Openeye Name: ethyl (3S)-1-[2-(3-methylanilino)thiazole-4-carbonyl]piperidine-3-carboxylate CAS Name: (3S)-1-[[2-(3-methylanilino)-4-thiazolyl]-oxomethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl (3S)-1-[2-(3-methylanilino)-1,3-thiazole-4-carbonyl]piperidine-3-carboxylate Traditional Name: (3S)-1-[2-(m-toluidino)thiazole-4-carbonyl]nipecotic acid ethyl ester Formula: C19H23N3O3S MolecularWeight: 373.46922

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)C2=CSC(=N2)NC3=CC=CC(=C3)C

Isomeric SMILES

CCOC(=O)[C@H]1CCCN(C1)C(=O)C2=CSC(=N2)NC3=CC=CC(=C3)C

InChI

InChI=1S/C19H23N3O3S/c1-3-25-18(24)14-7-5-9-22(11-14)17(23)16-12-26-19(21-16)20-15-8-4-6-13(2)10-15/h4,6,8,10,12,14H,3,5,7,9,11H2,1-2H3,(H,20,21)/t14-/m0/s1