methyl 2-[3-[4-(2,3-dihydro-1-benzofuran-5-ylmethyl)-1,3-thiazol-2-yl]phenyl]pyrazolidine-1-carboxylate

Systemtic Name: methyl 2-[3-[4-(2,3-dihydro-1-benzofuran-5-ylmethyl)-1,3-thiazol-2-yl]phenyl]pyrazolidine-1-carboxylate Openeye Name: methyl 2-[3-[4-(2,3-dihydrobenzofuran-5-ylmethyl)thiazol-2-yl]phenyl]pyrazolidine-1-carboxylate CAS Name: 2-[3-[4-(2,3-dihydrobenzofuran-5-ylmethyl)-2-thiazolyl]phenyl]-1-pyrazolidinecarboxylic acid methyl ester IUPAC Name: methyl 2-[3-[4-(2,3-dihydro-1-benzofuran-5-ylmethyl)-1,3-thiazol-2-yl]phenyl]pyrazolidine-1-carboxylate Traditional Name: 2-[3-[4-(coumaran-5-ylmethyl)thiazol-2-yl]phenyl]pyrazolidine-1-carboxylic acid methyl ester Formula: C23H23N3O3S MolecularWeight: 421.51202

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)N1CCCN1C2=CC=CC(=C2)C3=NC(=CS3)CC4=CC5=C(C=C4)OCC5

Isomeric SMILES

COC(=O)N1CCCN1C2=CC=CC(=C2)C3=NC(=CS3)CC4=CC5=C(C=C4)OCC5

InChI

InChI=1S/C23H23N3O3S/c1-28-23(27)26-10-3-9-25(26)20-5-2-4-18(14-20)22-24-19(15-30-22)13-16-6-7-21-17(12-16)8-11-29-21/h2,4-7,12,14-15H,3,8-11,13H2,1H3