N-[5-(4-dimethylaminophenyl)-1,3,4-thiadiazol-2-yl]-1-(3,3-dimethylbutanoyl)pyrrolidine-2-carboxamide

Systemtic Name: N-[5-(4-dimethylaminophenyl)-1,3,4-thiadiazol-2-yl]-1-(3,3-dimethylbutanoyl)pyrrolidine-2-carboxamide Openeye Name: N-[5-(4-dimethylaminophenyl)-1,3,4-thiadiazol-2-yl]-1-(3,3-dimethylbutanoyl)pyrrolidine-2-carboxamide CAS Name: N-[5-(4-dimethylaminophenyl)-1,3,4-thiadiazol-2-yl]-1-(3,3-dimethyl-1-oxobutyl)-2-pyrrolidinecarboxamide IUPAC Name: N-[5-(4-dimethylaminophenyl)-1,3,4-thiadiazol-2-yl]-1-(3,3-dimethylbutanoyl)pyrrolidine-2-carboxamide Traditional Name: N-[5-(4-dimethylaminophenyl)-1,3,4-thiadiazol-2-yl]-1-(3,3-dimethylbutanoyl)pyrrolidine-2-carboxamide Formula: C21H29N5O2S MolecularWeight: 415.55226

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(=O)N1CCCC1C(=O)NC2=NN=C(S2)C3=CC=C(C=C3)N(C)C

Isomeric SMILES

CC(C)(C)CC(=O)N1CCCC1C(=O)NC2=NN=C(S2)C3=CC=C(C=C3)N(C)C

InChI

InChI=1S/C21H29N5O2S/c1-21(2,3)13-17(27)26-12-6-7-16(26)18(28)22-20-24-23-19(29-20)14-8-10-15(11-9-14)25(4)5/h8-11,16H,6-7,12-13H2,1-5H3,(H,22,24,28)