ethyl (3R)-3-[(E)-3-phenylprop-2-enyl]-1-(1,2,3-thiadiazol-4-ylcarbonyl)piperidine-3-carboxylate

Systemtic Name: ethyl (3R)-3-[(E)-3-phenylprop-2-enyl]-1-(1,2,3-thiadiazol-4-ylcarbonyl)piperidine-3-carboxylate Openeye Name: ethyl (3R)-3-[(E)-cinnamyl]-1-(thiadiazole-4-carbonyl)piperidine-3-carboxylate CAS Name: (3R)-1-[oxo(4-thiadiazolyl)methyl]-3-[(E)-3-phenylprop-2-enyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl (3R)-3-[(E)-3-phenylprop-2-enyl]-1-(thiadiazole-4-carbonyl)piperidine-3-carboxylate Traditional Name: (3R)-3-[(E)-cinnamyl]-1-(thiadiazole-4-carbonyl)nipecotic acid ethyl ester Formula: C20H23N3O3S MolecularWeight: 385.47992

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCCN(C1)C(=O)C2=CSN=N2)CC=CC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)[C@]1(CCCN(C1)C(=O)C2=CSN=N2)C/C=C/C3=CC=CC=C3

InChI

InChI=1S/C20H23N3O3S/c1-2-26-19(25)20(11-6-10-16-8-4-3-5-9-16)12-7-13-23(15-20)18(24)17-14-27-22-21-17/h3-6,8-10,14H,2,7,11-13,15H2,1H3/b10-6+/t20-/m0/s1