4-[(4-bromophenyl)sulfonyl-methyl-amino]-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-phenyl-butanamide

Systemtic Name: 4-[(4-bromophenyl)sulfonyl-methyl-amino]-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-phenyl-butanamide Openeye Name: 4-[(4-bromophenyl)sulfonyl-methyl-amino]-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-phenyl-butanamide CAS Name: 4-[(4-bromophenyl)sulfonyl-methylamino]-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-phenylbutanamide IUPAC Name: 4-[(4-bromophenyl)sulfonyl-methylamino]-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-phenylbutanamide Traditional Name: 4-[brosyl(methyl)amino]-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-phenyl-butyramide Formula: C21H23BrN4O3S2 MolecularWeight: 523.46632

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN=C(S1)NC(=O)CC(CN(C)S(=O)(=O)C2=CC=C(C=C2)Br)C3=CC=CC=C3

Isomeric SMILES

CCC1=NN=C(S1)NC(=O)CC(CN(C)S(=O)(=O)C2=CC=C(C=C2)Br)C3=CC=CC=C3

InChI

InChI=1S/C21H23BrN4O3S2/c1-3-20-24-25-21(30-20)23-19(27)13-16(15-7-5-4-6-8-15)14-26(2)31(28,29)18-11-9-17(22)10-12-18/h4-12,16H,3,13-14H2,1-2H3,(H,23,25,27)