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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC1=NN=C(S1)C2=CC=CC=C2)NC(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CCC(C)C(C(=O)NC1=NN=C(S1)C2=CC=CC=C2)NC(=O)C3=CC=C(C=C3)Br

InChI

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