tert-butyl 2-[5-(3-pyridin-3-ylpropyl)-1,3,4-thiadiazol-2-yl]pyrrolidine-1-carboxylate

Systemtic Name: tert-butyl 2-[5-(3-pyridin-3-ylpropyl)-1,3,4-thiadiazol-2-yl]pyrrolidine-1-carboxylate Openeye Name: tert-butyl 2-[5-[3-(3-pyridyl)propyl]-1,3,4-thiadiazol-2-yl]pyrrolidine-1-carboxylate CAS Name: 2-[5-[3-(3-pyridinyl)propyl]-1,3,4-thiadiazol-2-yl]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-[5-(3-pyridin-3-ylpropyl)-1,3,4-thiadiazol-2-yl]pyrrolidine-1-carboxylate Traditional Name: 2-[5-[3-(3-pyridyl)propyl]-1,3,4-thiadiazol-2-yl]pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C19H26N4O2S MolecularWeight: 374.50034

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC1C2=NN=C(S2)CCCC3=CN=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCC1C2=NN=C(S2)CCCC3=CN=CC=C3

InChI

InChI=1S/C19H26N4O2S/c1-19(2,3)25-18(24)23-12-6-9-15(23)17-22-21-16(26-17)10-4-7-14-8-5-11-20-13-14/h5,8,11,13,15H,4,6-7,9-10,12H2,1-3H3