tert-butyl 4-[4-(6-propan-2-yloxy-1,3-benzothiazol-2-yl)piperazin-1-yl]-2-(1,3-thiazolidin-3-ylcarbonyl)pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl 4-[4-(6-propan-2-yloxy-1,3-benzothiazol-2-yl)piperazin-1-yl]-2-(1,3-thiazolidin-3-ylcarbonyl)pyrrolidine-1-carboxylate Openeye Name: tert-butyl 4-[4-(6-isopropoxy-1,3-benzothiazol-2-yl)piperazin-1-yl]-2-(thiazolidine-3-carbonyl)pyrrolidine-1-carboxylate CAS Name: 2-[oxo(3-thiazolidinyl)methyl]-4-[4-(6-propan-2-yloxy-1,3-benzothiazol-2-yl)-1-piperazinyl]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-(6-propan-2-yloxy-1,3-benzothiazol-2-yl)piperazin-1-yl]-2-(1,3-thiazolidine-3-carbonyl)pyrrolidine-1-carboxylate Traditional Name: 4-[4-(6-isopropoxy-1,3-benzothiazol-2-yl)piperazino]-2-(thiazolidine-3-carbonyl)pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C27H39N5O4S2 MolecularWeight: 561.75966

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC2=C(C=C1)N=C(S2)N3CCN(CC3)C4CC(N(C4)C(=O)OC(C)(C)C)C(=O)N5CCSC5

Isomeric SMILES

CC(C)OC1=CC2=C(C=C1)N=C(S2)N3CCN(CC3)C4CC(N(C4)C(=O)OC(C)(C)C)C(=O)N5CCSC5

InChI

InChI=1S/C27H39N5O4S2/c1-18(2)35-20-6-7-21-23(15-20)38-25(28-21)30-10-8-29(9-11-30)19-14-22(24(33)31-12-13-37-17-31)32(16-19)26(34)36-27(3,4)5/h6-7,15,18-19,22H,8-14,16-17H2,1-5H3