tert-butyl 4-[5-[4-(6-chloranylnaphthalen-2-yl)sulfonylpiperazin-1-yl]carbonyl-4-methyl-1,3-thiazol-2-yl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[5-[4-(6-chloranylnaphthalen-2-yl)sulfonylpiperazin-1-yl]carbonyl-4-methyl-1,3-thiazol-2-yl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[5-[4-[(6-chloro-2-naphthyl)sulfonyl]piperazine-1-carbonyl]-4-methyl-thiazol-2-yl]piperidine-1-carboxylate CAS Name: 4-[5-[[4-[(6-chloro-2-naphthalenyl)sulfonyl]-1-piperazinyl]-oxomethyl]-4-methyl-2-thiazolyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[5-[4-(6-chloronaphthalen-2-yl)sulfonylpiperazine-1-carbonyl]-4-methyl-1,3-thiazol-2-yl]piperidine-1-carboxylate Traditional Name: 4-[5-[4-[(6-chloro-2-naphthyl)sulfonyl]piperazine-1-carbonyl]-4-methyl-thiazol-2-yl]piperidine-1-carboxylic acid tert-butyl ester Formula: C29H35ClN4O5S2 MolecularWeight: 619.195

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)C2CCN(CC2)C(=O)OC(C)(C)C)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC5=C(C=C4)C=C(C=C5)Cl

Isomeric SMILES

CC1=C(SC(=N1)C2CCN(CC2)C(=O)OC(C)(C)C)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC5=C(C=C4)C=C(C=C5)Cl

InChI

InChI=1S/C29H35ClN4O5S2/c1-19-25(40-26(31-19)20-9-11-33(12-10-20)28(36)39-29(2,3)4)27(35)32-13-15-34(16-14-32)41(37,38)24-8-6-21-17-23(30)7-5-22(21)18-24/h5-8,17-18,20H,9-16H2,1-4H3