AC1NSQS4

2-[4-hydroxy-5-(2-oxoindol-3-yl)-2-sulfanylidene-1,3-thiazol-3-yl]-4-methylpentanoic acid

Also Known As: CBMicro_048305|Oprea1_218686|Oprea1_220489|BAS 00777872|BIM-0048182.P001|AF-399/09656013|4-methyl-2-[4-oxo-5-(2-oxo-1,2-dihydro-3H-indol-3-ylidene)-2-thioxo-1,3-thiazolidin-3-yl]pentanoic acid|4-methyl-2-[(5E)-4-oxo-5-(2-oxo-1H-indol-3-ylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]pentanoic acid|4-methyl-2-[(5Z)-4-oxo-5-(2-oxo-1,2-dihydro-3H-indol-3-ylidene)-2-thioxo-1,3-thiazolidin-3-yl]pentanoic acid|4-methyl-2-[(5Z)-4-oxo-5-(2-oxo-1H-indol-3-ylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]pentanoic acid|4-methyl-2-[4-oxo-5-(2-oxo(1H-benzo[d]azolin-3-ylidene))-2-thioxo(1,3-thiazoli din-3-yl)]pentanoic acid|4-methyl-2-[4-oxo-5-(2-oxo-1H-indol-3-ylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]pentanoic acid

Molecular Formula	C17H16N2O4S2
Molecular Weight	376.05515 g/mol
LogP	2.01529
Topological Polar Surface Area	91.89 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	5
Rotatable Bonds	5
Exact Mass	376.05515
Monoisotopic Mass	376.05515
Heavy Atoms	25
Complexity	1049.3307

Chemical Identifiers

CAS Number	5258-50-4
SMILES	CC(C)CC(C(=O)O)N1C(=C(SC1=S)C2=C3C=CC=CC3=NC2=O)O