tert-butyl 4-[2-[2-(2-ethoxyphenyl)-1,3-thiazol-4-yl]ethanoyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[2-[2-(2-ethoxyphenyl)-1,3-thiazol-4-yl]ethanoyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[2-[2-(2-ethoxyphenyl)thiazol-4-yl]acetyl]piperazine-1-carboxylate CAS Name: 4-[2-[2-(2-ethoxyphenyl)-4-thiazolyl]-1-oxoethyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[2-[2-(2-ethoxyphenyl)-1,3-thiazol-4-yl]acetyl]piperazine-1-carboxylate Traditional Name: 4-[2-(2-o-phenetylthiazol-4-yl)acetyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C22H29N3O4S MolecularWeight: 431.54836

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C2=NC(=CS2)CC(=O)N3CCN(CC3)C(=O)OC(C)(C)C

Isomeric SMILES

CCOC1=CC=CC=C1C2=NC(=CS2)CC(=O)N3CCN(CC3)C(=O)OC(C)(C)C

InChI

InChI=1S/C22H29N3O4S/c1-5-28-18-9-7-6-8-17(18)20-23-16(15-30-20)14-19(26)24-10-12-25(13-11-24)21(27)29-22(2,3)4/h6-9,15H,5,10-14H2,1-4H3