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

Systemtic Name: N-[5-(1,3-benzodioxol-5-yl)-1,3,4-thiadiazol-2-yl]-1-heptanoyl-pyrrolidine-2-carboxamide Openeye Name: N-[5-(1,3-benzodioxol-5-yl)-1,3,4-thiadiazol-2-yl]-1-heptanoyl-pyrrolidine-2-carboxamide CAS Name: N-[5-(1,3-benzodioxol-5-yl)-1,3,4-thiadiazol-2-yl]-1-(1-oxoheptyl)-2-pyrrolidinecarboxamide IUPAC Name: N-[5-(1,3-benzodioxol-5-yl)-1,3,4-thiadiazol-2-yl]-1-heptanoylpyrrolidine-2-carboxamide Traditional Name: N-[5-(1,3-benzodioxol-5-yl)-1,3,4-thiadiazol-2-yl]-1-enanthyl-pyrrolidine-2-carboxamide Formula: C21H26N4O4S MolecularWeight: 430.52054

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=O)N1CCCC1C(=O)NC2=NN=C(S2)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCCCCCC(=O)N1CCCC1C(=O)NC2=NN=C(S2)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H26N4O4S/c1-2-3-4-5-8-18(26)25-11-6-7-15(25)19(27)22-21-24-23-20(30-21)14-9-10-16-17(12-14)29-13-28-16/h9-10,12,15H,2-8,11,13H2,1H3,(H,22,24,27)