4-bromanyl-N-[5-(undecylamino)-1,3,4-thiadiazol-2-yl]benzamide

Systemtic Name: 4-bromanyl-N-[5-(undecylamino)-1,3,4-thiadiazol-2-yl]benzamide Openeye Name: 4-bromo-N-[5-(undecylamino)-1,3,4-thiadiazol-2-yl]benzamide CAS Name: 4-bromo-N-[5-(undecylamino)-1,3,4-thiadiazol-2-yl]benzamide IUPAC Name: 4-bromo-N-[5-(undecylamino)-1,3,4-thiadiazol-2-yl]benzamide Traditional Name: 4-bromo-N-[5-(undecylamino)-1,3,4-thiadiazol-2-yl]benzamide Formula: C20H29BrN4OS MolecularWeight: 453.43946

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCNC1=NN=C(S1)NC(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

CCCCCCCCCCCNC1=NN=C(S1)NC(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C20H29BrN4OS/c1-2-3-4-5-6-7-8-9-10-15-22-19-24-25-20(27-19)23-18(26)16-11-13-17(21)14-12-16/h11-14H,2-10,15H2,1H3,(H,22,24)(H,23,25,26)