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

Systemtic Name: 4-bromanyl-N-[5-(3-imidazol-1-ylpropylamino)-1,3,4-thiadiazol-2-yl]benzamide Openeye Name: 4-bromo-N-[5-(3-imidazol-1-ylpropylamino)-1,3,4-thiadiazol-2-yl]benzamide CAS Name: 4-bromo-N-[5-[3-(1-imidazolyl)propylamino]-1,3,4-thiadiazol-2-yl]benzamide IUPAC Name: 4-bromo-N-[5-(3-imidazol-1-ylpropylamino)-1,3,4-thiadiazol-2-yl]benzamide Traditional Name: 4-bromo-N-[5-(3-imidazol-1-ylpropylamino)-1,3,4-thiadiazol-2-yl]benzamide Formula: C15H15BrN6OS MolecularWeight: 407.2882

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NC2=NN=C(S2)NCCCN3C=CN=C3)Br

Isomeric SMILES

C1=CC(=CC=C1C(=O)NC2=NN=C(S2)NCCCN3C=CN=C3)Br

InChI

InChI=1S/C15H15BrN6OS/c16-12-4-2-11(3-5-12)13(23)19-15-21-20-14(24-15)18-6-1-8-22-9-7-17-10-22/h2-5,7,9-10H,1,6,8H2,(H,18,20)(H,19,21,23)