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

Systemtic Name: (2R)-1-heptanoyl-N-[5-(3-methoxyphenyl)-1,3,4-thiadiazol-2-yl]pyrrolidine-2-carboxamide Openeye Name: (2R)-1-heptanoyl-N-[5-(3-methoxyphenyl)-1,3,4-thiadiazol-2-yl]pyrrolidine-2-carboxamide CAS Name: (2R)-N-[5-(3-methoxyphenyl)-1,3,4-thiadiazol-2-yl]-1-(1-oxoheptyl)-2-pyrrolidinecarboxamide IUPAC Name: (2R)-1-heptanoyl-N-[5-(3-methoxyphenyl)-1,3,4-thiadiazol-2-yl]pyrrolidine-2-carboxamide Traditional Name: (2R)-1-enanthyl-N-[5-(3-methoxyphenyl)-1,3,4-thiadiazol-2-yl]pyrrolidine-2-carboxamide Formula: C21H28N4O3S MolecularWeight: 416.53702

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCCCCCC(=O)N1CCC[C@@H]1C(=O)NC2=NN=C(S2)C3=CC(=CC=C3)OC

InChI

InChI=1S/C21H28N4O3S/c1-3-4-5-6-12-18(26)25-13-8-11-17(25)19(27)22-21-24-23-20(29-21)15-9-7-10-16(14-15)28-2/h7,9-10,14,17H,3-6,8,11-13H2,1-2H3,(H,22,24,27)/t17-/m1/s1