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

Systemtic Name: tert-butyl 4-(3,4-dicyanophenyl)-4-piperazin-1-yl-2-(1,3-thiazolidin-3-ylcarbonyl)pyrrolidine-1-carboxylate Openeye Name: tert-butyl 4-(3,4-dicyanophenyl)-4-piperazin-1-yl-2-(thiazolidine-3-carbonyl)pyrrolidine-1-carboxylate CAS Name: 4-(3,4-dicyanophenyl)-2-[oxo(3-thiazolidinyl)methyl]-4-(1-piperazinyl)-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(3,4-dicyanophenyl)-4-piperazin-1-yl-2-(1,3-thiazolidine-3-carbonyl)pyrrolidine-1-carboxylate Traditional Name: 4-(3,4-dicyanophenyl)-4-piperazino-2-(thiazolidine-3-carbonyl)pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C25H32N6O3S MolecularWeight: 496.62498

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CC(CC1C(=O)N2CCSC2)(C3=CC(=C(C=C3)C#N)C#N)N4CCNCC4

Isomeric SMILES

CC(C)(C)OC(=O)N1CC(CC1C(=O)N2CCSC2)(C3=CC(=C(C=C3)C#N)C#N)N4CCNCC4

InChI

InChI=1S/C25H32N6O3S/c1-24(2,3)34-23(33)31-16-25(30-8-6-28-7-9-30,13-21(31)22(32)29-10-11-35-17-29)20-5-4-18(14-26)19(12-20)15-27/h4-5,12,21,28H,6-11,13,16-17H2,1-3H3