ethyl 4-[1-[(2-phenyl-1,3-thiazol-5-yl)methyl]piperidin-3-yl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[1-[(2-phenyl-1,3-thiazol-5-yl)methyl]piperidin-3-yl]piperazine-1-carboxylate Openeye Name: ethyl 4-[1-[(2-phenylthiazol-5-yl)methyl]-3-piperidyl]piperazine-1-carboxylate CAS Name: 4-[1-[(2-phenyl-5-thiazolyl)methyl]-3-piperidinyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[1-[(2-phenyl-1,3-thiazol-5-yl)methyl]piperidin-3-yl]piperazine-1-carboxylate Traditional Name: 4-[1-[(2-phenylthiazol-5-yl)methyl]-3-piperidyl]piperazine-1-carboxylic acid ethyl ester Formula: C22H30N4O2S MolecularWeight: 414.5642

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C2CCCN(C2)CC3=CN=C(S3)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C2CCCN(C2)CC3=CN=C(S3)C4=CC=CC=C4

InChI

InChI=1S/C22H30N4O2S/c1-2-28-22(27)26-13-11-25(12-14-26)19-9-6-10-24(16-19)17-20-15-23-21(29-20)18-7-4-3-5-8-18/h3-5,7-8,15,19H,2,6,9-14,16-17H2,1H3