Methanethiol, N-(3-benzyloxypropyl)amidino-, hydrogen sulfate (ester)

3-[(1-amino-2-sulfosulfanylethylidene)amino]propoxymethylbenzene

Also Known As: 17-Deoxymethansone|Methanethiol, N-(3-benzyloxypropyl)amidino-, hydrogen sulfate (ester)|S-((N-(3-Benzyloxypropyl)amidino)methyl) hydrogen thiosulfate|3-[(1-amino-2-sulfosulfanylethylidene)amino]propoxymethylbenzene|s-[(2z)-2-amino-2-{[3-(benzyloxy)propyl]imino}ethyl] hydrogen sulfurothioate|3-[(2-sulfosulfanylethanimidoyl)amino]propoxymethylbenzene|Thiosulfuric acid (H2S2O3), S-(2-imino-2-((3-(phenylmethoxy)propyl)amino)ethyl) ester|Thiosulfuric acid (H2S2O3), S-[2-imino-2-[[3-(phenylmethoxy)propyl]amino]ethyl] ester|[({N-[3-(benzyloxy)propyl]carbamimidoyl}methyl)sulfanyl]sulfonic acid|S-(2-((3-(Benzyloxy)propyl)amino)-2-iminoethyl) hydrogen thiosulfate|Thiosulfuric acid (H2S2O3), {S-[2-imino-2-[[3-(phenylmethoxy)propyl]amino]ethyl]} ester|Thiosulfuric acid hydrogen S-[2-[3-(benzyloxy)propylamino]-2-iminoethyl] ester|Thiosulfuric acid (H2S2O3), S-(2-imino-2-((3-(phenylmethoxy)propyl)amino)ethyl) ester (9CI)

Molecular Formula	C12H18N2O4S2
Molecular Weight	318.0708 g/mol
LogP	1.49
Topological Polar Surface Area	101.98 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	5
Rotatable Bonds	9
Exact Mass	318.0708
Heavy Atoms	20
Complexity	517.5

Chemical Identifiers

CAS Number	40283-92-9
SMILES	C1=CC=C(C=C1)COCCCN=C(CSS(=O)(=O)O)N