N-(4-bromanyl-3-methyl-phenyl)-N'-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]butanediamide

Systemtic Name: N-(4-bromanyl-3-methyl-phenyl)-N'-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]butanediamide Openeye Name: N-(4-bromo-3-methyl-phenyl)-N'-(5-isobutyl-1,3,4-thiadiazol-2-yl)butanediamide CAS Name: N-(4-bromo-3-methylphenyl)-N'-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]butanediamide IUPAC Name: N-(4-bromo-3-methylphenyl)-N'-[5-(2-methylpropyl)-1,3,4-thiadiazol-2-yl]butanediamide Traditional Name: N-(4-bromo-3-methyl-phenyl)-N'-(5-isobutyl-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)CC(C)C)Br

Isomeric SMILES

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

InChI

InChI=1S/C17H21BrN4O2S/c1-10(2)8-16-21-22-17(25-16)20-15(24)7-6-14(23)19-12-4-5-13(18)11(3)9-12/h4-5,9-10H,6-8H2,1-3H3,(H,19,23)(H,20,22,24)