3-bromanyl-N-[4-[2-oxidanylidene-2-[(5-propyl-1,3,4-thiadiazol-2-yl)amino]ethyl]phenyl]benzamide

Systemtic Name: 3-bromanyl-N-[4-[2-oxidanylidene-2-[(5-propyl-1,3,4-thiadiazol-2-yl)amino]ethyl]phenyl]benzamide Openeye Name: 3-bromo-N-[4-[2-oxo-2-[(5-propyl-1,3,4-thiadiazol-2-yl)amino]ethyl]phenyl]benzamide CAS Name: 3-bromo-N-[4-[2-oxo-2-[(5-propyl-1,3,4-thiadiazol-2-yl)amino]ethyl]phenyl]benzamide IUPAC Name: 3-bromo-N-[4-[2-oxo-2-[(5-propyl-1,3,4-thiadiazol-2-yl)amino]ethyl]phenyl]benzamide Traditional Name: 3-bromo-N-[4-[2-keto-2-[(5-propyl-1,3,4-thiadiazol-2-yl)amino]ethyl]phenyl]benzamide Formula: C20H19BrN4O2S MolecularWeight: 459.35946

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN=C(S1)NC(=O)CC2=CC=C(C=C2)NC(=O)C3=CC(=CC=C3)Br

Isomeric SMILES

CCCC1=NN=C(S1)NC(=O)CC2=CC=C(C=C2)NC(=O)C3=CC(=CC=C3)Br

InChI

InChI=1S/C20H19BrN4O2S/c1-2-4-18-24-25-20(28-18)23-17(26)11-13-7-9-16(10-8-13)22-19(27)14-5-3-6-15(21)12-14/h3,5-10,12H,2,4,11H2,1H3,(H,22,27)(H,23,25,26)