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

Systemtic Name: tert-butyl 2-[5-[4-(4-dimethylaminophenyl)butyl]-1,3,4-thiadiazol-2-yl]pyrrolidine-1-carboxylate Openeye Name: tert-butyl 2-[5-[4-(4-dimethylaminophenyl)butyl]-1,3,4-thiadiazol-2-yl]pyrrolidine-1-carboxylate CAS Name: 2-[5-[4-(4-dimethylaminophenyl)butyl]-1,3,4-thiadiazol-2-yl]-1-pyrrolidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-[5-[4-(4-dimethylaminophenyl)butyl]-1,3,4-thiadiazol-2-yl]pyrrolidine-1-carboxylate Traditional Name: 2-[5-[4-(4-dimethylaminophenyl)butyl]-1,3,4-thiadiazol-2-yl]pyrrolidine-1-carboxylic acid tert-butyl ester Formula: C23H34N4O2S MolecularWeight: 430.60666

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCCC1C2=NN=C(S2)CCCCC3=CC=C(C=C3)N(C)C

Isomeric SMILES

CC(C)(C)OC(=O)N1CCCC1C2=NN=C(S2)CCCCC3=CC=C(C=C3)N(C)C

InChI

InChI=1S/C23H34N4O2S/c1-23(2,3)29-22(28)27-16-8-10-19(27)21-25-24-20(30-21)11-7-6-9-17-12-14-18(15-13-17)26(4)5/h12-15,19H,6-11,16H2,1-5H3