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

Systemtic Name: 4-iodanyl-N-[5-(3-pyrrolidin-1-ylpropylamino)-1,3,4-thiadiazol-2-yl]benzamide Openeye Name: 4-iodo-N-[5-(3-pyrrolidin-1-ylpropylamino)-1,3,4-thiadiazol-2-yl]benzamide CAS Name: 4-iodo-N-[5-[3-(1-pyrrolidinyl)propylamino]-1,3,4-thiadiazol-2-yl]benzamide IUPAC Name: 4-iodo-N-[5-(3-pyrrolidin-1-ylpropylamino)-1,3,4-thiadiazol-2-yl]benzamide Traditional Name: 4-iodo-N-[5-(3-pyrrolidinopropylamino)-1,3,4-thiadiazol-2-yl]benzamide Formula: C16H20IN5OS MolecularWeight: 457.33237

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CCCNC2=NN=C(S2)NC(=O)C3=CC=C(C=C3)I

Isomeric SMILES

C1CCN(C1)CCCNC2=NN=C(S2)NC(=O)C3=CC=C(C=C3)I

InChI

InChI=1S/C16H20IN5OS/c17-13-6-4-12(5-7-13)14(23)19-16-21-20-15(24-16)18-8-3-11-22-9-1-2-10-22/h4-7H,1-3,8-11H2,(H,18,20)(H,19,21,23)