RefChem:95463

N,N-diethylethanamine;2-[5-(3-ethyl-1,3-benzothiazol-2-ylidene)-2-sulfanylidene-1,3-thiazolidin-3-yl]acetic acid

Also Known As: EINECS 272-159-6|Triethylammonium 5-(3-ethylbenzothiazol-2(3H)-ylidene)-2-thioxothiazolidine-3-acetate|3-Thiazolidineacetic acid, 5-(3-ethyl-2(3H)-benzothiazolylidene)-2-thioxo-, compd. with N,N-diethylethanamine (1:1)

Molecular Formula	C20H29N3O2S3
Molecular Weight	439.14218 g/mol
LogP	4.55
Topological Polar Surface Area	47.02 Ų
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	6
Rotatable Bonds	6
Exact Mass	439.14218
Heavy Atoms	28
Complexity	729.7

Chemical Identifiers

CAS Number	68758-84-9
SMILES	CCN1C2=CC=CC=C2SC1=C3CN(C(=S)S3)CC(=O)O.CCN(CC)CC