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

Systemtic Name: 4-butyl-N-[1-oxidanylidene-1-[(5-phenyl-1,3,4-thiadiazol-2-yl)amino]propan-2-yl]benzamide Openeye Name: 4-butyl-N-[1-methyl-2-oxo-2-[(5-phenyl-1,3,4-thiadiazol-2-yl)amino]ethyl]benzamide CAS Name: 4-butyl-N-[1-oxo-1-[(5-phenyl-1,3,4-thiadiazol-2-yl)amino]propan-2-yl]benzamide IUPAC Name: 4-butyl-N-[1-oxo-1-[(5-phenyl-1,3,4-thiadiazol-2-yl)amino]propan-2-yl]benzamide Traditional Name: 4-butyl-N-[2-keto-1-methyl-2-[(5-phenyl-1,3,4-thiadiazol-2-yl)amino]ethyl]benzamide Formula: C22H24N4O2S MolecularWeight: 408.51656

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C(=O)NC(C)C(=O)NC2=NN=C(S2)C3=CC=CC=C3

Isomeric SMILES

CCCCC1=CC=C(C=C1)C(=O)NC(C)C(=O)NC2=NN=C(S2)C3=CC=CC=C3

InChI

InChI=1S/C22H24N4O2S/c1-3-4-8-16-11-13-17(14-12-16)20(28)23-15(2)19(27)24-22-26-25-21(29-22)18-9-6-5-7-10-18/h5-7,9-15H,3-4,8H2,1-2H3,(H,23,28)(H,24,26,27)