N-(4-bromanyl-3-methyl-phenyl)-N'-(5-tert-butyl-1,3,4-thiadiazol-2-yl)butanediamide

Systemtic Name: N-(4-bromanyl-3-methyl-phenyl)-N'-(5-tert-butyl-1,3,4-thiadiazol-2-yl)butanediamide Openeye Name: N-(4-bromo-3-methyl-phenyl)-N'-(5-tert-butyl-1,3,4-thiadiazol-2-yl)butanediamide CAS Name: N-(4-bromo-3-methylphenyl)-N'-(5-tert-butyl-1,3,4-thiadiazol-2-yl)butanediamide IUPAC Name: N-(4-bromo-3-methylphenyl)-N'-(5-tert-butyl-1,3,4-thiadiazol-2-yl)butanediamide Traditional Name: N-(4-bromo-3-methyl-phenyl)-N'-(5-tert-butyl-1,3,4-thiadiazol-2-yl)succinamide Formula: C17H21BrN4O2S MolecularWeight: 425.34324

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)CCC(=O)NC2=NN=C(S2)C(C)(C)C)Br

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)CCC(=O)NC2=NN=C(S2)C(C)(C)C)Br

InChI

InChI=1S/C17H21BrN4O2S/c1-10-9-11(5-6-12(10)18)19-13(23)7-8-14(24)20-16-22-21-15(25-16)17(2,3)4/h5-6,9H,7-8H2,1-4H3,(H,19,23)(H,20,22,24)