tert-butyl 4-[4-[4-(4-cyanophenyl)piperazin-1-yl]carbonyl-1,3-thiazol-2-yl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[4-[4-(4-cyanophenyl)piperazin-1-yl]carbonyl-1,3-thiazol-2-yl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[4-[4-(4-cyanophenyl)piperazine-1-carbonyl]thiazol-2-yl]piperidine-1-carboxylate CAS Name: 4-[4-[[4-(4-cyanophenyl)-1-piperazinyl]-oxomethyl]-2-thiazolyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-[4-(4-cyanophenyl)piperazine-1-carbonyl]-1,3-thiazol-2-yl]piperidine-1-carboxylate Traditional Name: 4-[4-[4-(4-cyanophenyl)piperazine-1-carbonyl]thiazol-2-yl]piperidine-1-carboxylic acid tert-butyl ester Formula: C25H31N5O3S MolecularWeight: 481.61034

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)C2=NC(=CS2)C(=O)N3CCN(CC3)C4=CC=C(C=C4)C#N

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)C2=NC(=CS2)C(=O)N3CCN(CC3)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C25H31N5O3S/c1-25(2,3)33-24(32)30-10-8-19(9-11-30)22-27-21(17-34-22)23(31)29-14-12-28(13-15-29)20-6-4-18(16-26)5-7-20/h4-7,17,19H,8-15H2,1-3H3