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

Systemtic Name: N-[5-(3-bromophenyl)-1,3,4-thiadiazol-2-yl]-1-heptanoyl-pyrrolidine-2-carboxamide Openeye Name: N-[5-(3-bromophenyl)-1,3,4-thiadiazol-2-yl]-1-heptanoyl-pyrrolidine-2-carboxamide CAS Name: N-[5-(3-bromophenyl)-1,3,4-thiadiazol-2-yl]-1-(1-oxoheptyl)-2-pyrrolidinecarboxamide IUPAC Name: N-[5-(3-bromophenyl)-1,3,4-thiadiazol-2-yl]-1-heptanoylpyrrolidine-2-carboxamide Traditional Name: N-[5-(3-bromophenyl)-1,3,4-thiadiazol-2-yl]-1-enanthyl-pyrrolidine-2-carboxamide Formula: C20H25BrN4O2S MolecularWeight: 465.4071

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)N1CCCC1C(=O)NC2=NN=C(S2)C3=CC(=CC=C3)Br

Isomeric SMILES

CCCCCCC(=O)N1CCCC1C(=O)NC2=NN=C(S2)C3=CC(=CC=C3)Br

InChI

InChI=1S/C20H25BrN4O2S/c1-2-3-4-5-11-17(26)25-12-7-10-16(25)18(27)22-20-24-23-19(28-20)14-8-6-9-15(21)13-14/h6,8-9,13,16H,2-5,7,10-12H2,1H3,(H,22,24,27)