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

Systemtic Name: 3-bromanyl-N-[4-[2-[(5-butyl-1,3,4-thiadiazol-2-yl)amino]-2-oxidanylidene-ethyl]phenyl]benzamide Openeye Name: 3-bromo-N-[4-[2-[(5-butyl-1,3,4-thiadiazol-2-yl)amino]-2-oxo-ethyl]phenyl]benzamide CAS Name: 3-bromo-N-[4-[2-[(5-butyl-1,3,4-thiadiazol-2-yl)amino]-2-oxoethyl]phenyl]benzamide IUPAC Name: 3-bromo-N-[4-[2-[(5-butyl-1,3,4-thiadiazol-2-yl)amino]-2-oxoethyl]phenyl]benzamide Traditional Name: 3-bromo-N-[4-[2-[(5-butyl-1,3,4-thiadiazol-2-yl)amino]-2-keto-ethyl]phenyl]benzamide Formula: C21H21BrN4O2S MolecularWeight: 473.38604

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NN=C(S1)NC(=O)CC2=CC=C(C=C2)NC(=O)C3=CC(=CC=C3)Br

Isomeric SMILES

CCCCC1=NN=C(S1)NC(=O)CC2=CC=C(C=C2)NC(=O)C3=CC(=CC=C3)Br

InChI

InChI=1S/C21H21BrN4O2S/c1-2-3-7-19-25-26-21(29-19)24-18(27)12-14-8-10-17(11-9-14)23-20(28)15-5-4-6-16(22)13-15/h4-6,8-11,13H,2-3,7,12H2,1H3,(H,23,28)(H,24,26,27)