N-(4-bromanyl-2-methyl-phenyl)-2-[[5-(cyclohexylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanamide

Systemtic Name: N-(4-bromanyl-2-methyl-phenyl)-2-[[5-(cyclohexylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanamide Openeye Name: N-(4-bromo-2-methyl-phenyl)-2-[[5-(cyclohexylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]acetamide CAS Name: N-(4-bromo-2-methylphenyl)-2-[[5-(cyclohexylamino)-1,3,4-thiadiazol-2-yl]thio]acetamide IUPAC Name: N-(4-bromo-2-methylphenyl)-2-[[5-(cyclohexylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]acetamide Traditional Name: N-(4-bromo-2-methyl-phenyl)-2-[[5-(cyclohexylamino)-1,3,4-thiadiazol-2-yl]thio]acetamide Formula: C17H21BrN4OS2 MolecularWeight: 441.40884

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)CSC2=NN=C(S2)NC3CCCCC3

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)CSC2=NN=C(S2)NC3CCCCC3

InChI

InChI=1S/C17H21BrN4OS2/c1-11-9-12(18)7-8-14(11)20-15(23)10-24-17-22-21-16(25-17)19-13-5-3-2-4-6-13/h7-9,13H,2-6,10H2,1H3,(H,19,21)(H,20,23)