4-iodanyl-N-[5-[3-(2-oxidanylidenepyrrolidin-1-yl)propylamino]-1,3,4-thiadiazol-2-yl]benzamide

Systemtic Name: 4-iodanyl-N-[5-[3-(2-oxidanylidenepyrrolidin-1-yl)propylamino]-1,3,4-thiadiazol-2-yl]benzamide Openeye Name: 4-iodo-N-[5-[3-(2-oxopyrrolidin-1-yl)propylamino]-1,3,4-thiadiazol-2-yl]benzamide CAS Name: 4-iodo-N-[5-[3-(2-oxo-1-pyrrolidinyl)propylamino]-1,3,4-thiadiazol-2-yl]benzamide IUPAC Name: 4-iodo-N-[5-[3-(2-oxopyrrolidin-1-yl)propylamino]-1,3,4-thiadiazol-2-yl]benzamide Traditional Name: 4-iodo-N-[5-[3-(2-ketopyrrolidino)propylamino]-1,3,4-thiadiazol-2-yl]benzamide Formula: C16H18IN5O2S MolecularWeight: 471.31589

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)CCCNC2=NN=C(S2)NC(=O)C3=CC=C(C=C3)I

Isomeric SMILES

C1CC(=O)N(C1)CCCNC2=NN=C(S2)NC(=O)C3=CC=C(C=C3)I

InChI

InChI=1S/C16H18IN5O2S/c17-12-6-4-11(5-7-12)14(24)19-16-21-20-15(25-16)18-8-2-10-22-9-1-3-13(22)23/h4-7H,1-3,8-10H2,(H,18,20)(H,19,21,24)