AC1MHN9V

2-tert-butyl-1-(2-methylquinolin-4-yl)-3-(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)guanidine

Also Known As: Guanidine, 1-tert-butyl-3-(5-mercapto-1,3,4-thiadiazol-2-yl)-2-(2-methyl-4-quinolyl)-|Guanidine, N-(4,5-dihydro-5-thioxo-1,3,4-thiadiazol-2-yl)-N'-(1,1-dimethylethyl)-N''-(2-methyl-4-quinolinyl)-|1-(tert-Butyl)-2-(2-methylquinolin-4-yl)-3-(5-thioxo-4,5-dihydro-1,3,4-thiadiazol-2-yl)guanidine|2-tert-butyl-1-(2-methylquinolin-4-yl)-3-(2-sulfanylidene-3H-1,3,4-thiadiazol-5-yl)guanidine|N-tert-Butyl-N'-(2-methylquinolin-4(1H)-ylidene)-N''-(5-sulfanyl-1,3,4-thiadiazol-2-yl)guanidine

Molecular Formula	C17H20N6S2
Molecular Weight	372.11908 g/mol
LogP	4.73581
Topological Polar Surface Area	77.99 Ų
Hydrogen Bond Donors	3
Hydrogen Bond Acceptors	5
Rotatable Bonds	2
Exact Mass	372.11908
Monoisotopic Mass	372.11908
Heavy Atoms	25
Complexity	980.45703

Chemical Identifiers

CAS Number	71253-69-5
SMILES	CC1=NC2=CC=CC=C2C(=C1)NC(=NC(C)(C)C)NC3=NNC(=S)S3