tert-butyl 4-[4-(4-nitronaphthalen-1-yl)piperazin-1-yl]-2-(1,3-thiazolidin-3-ylcarbonyl)pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl 4-[4-(4-nitronaphthalen-1-yl)piperazin-1-yl]-2-(1,3-thiazolidin-3-ylcarbonyl)pyrrolidine-1-carboxylate Openeye Name: tert-butyl 4-[4-(4-nitro-1-naphthyl)piperazin-1-yl]-2-(thiazolidine-3-carbonyl)pyrrolidine-1-carboxylate CAS Name: 4-[4-(4-nitro-1-naphthalenyl)-1-piperazinyl]-2-[oxo(3-thiazolidinyl)methyl]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-(4-nitronaphthalen-1-yl)piperazin-1-yl]-2-(1,3-thiazolidine-3-carbonyl)pyrrolidine-1-carboxylate Traditional Name: 4-[4-(4-nitro-1-naphthyl)piperazino]-2-(thiazolidine-3-carbonyl)pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C27H35N5O5S MolecularWeight: 541.6623

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CC(CC1C(=O)N2CCSC2)N3CCN(CC3)C4=CC=C(C5=CC=CC=C54)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)OC(=O)N1CC(CC1C(=O)N2CCSC2)N3CCN(CC3)C4=CC=C(C5=CC=CC=C54)[N+](=O)[O-]

InChI

InChI=1S/C27H35N5O5S/c1-27(2,3)37-26(34)31-17-19(16-24(31)25(33)30-14-15-38-18-30)28-10-12-29(13-11-28)22-8-9-23(32(35)36)21-7-5-4-6-20(21)22/h4-9,19,24H,10-18H2,1-3H3