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

Systemtic Name: N-(4-bromanyl-3-methyl-phenyl)-N'-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)butanediamide Openeye Name: N-(4-bromo-3-methyl-phenyl)-N'-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)butanediamide CAS Name: N-(4-bromo-3-methylphenyl)-N'-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)butanediamide IUPAC Name: N-(4-bromo-3-methylphenyl)-N'-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)butanediamide Traditional Name: N-(4-bromo-3-methyl-phenyl)-N'-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)succinamide Formula: C19H23BrN4O2S MolecularWeight: 451.38052

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)CCC(=O)NC2=NN=C(S2)C3CCCCC3)Br

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)CCC(=O)NC2=NN=C(S2)C3CCCCC3)Br

InChI

InChI=1S/C19H23BrN4O2S/c1-12-11-14(7-8-15(12)20)21-16(25)9-10-17(26)22-19-24-23-18(27-19)13-5-3-2-4-6-13/h7-8,11,13H,2-6,9-10H2,1H3,(H,21,25)(H,22,24,26)