Vitas-M small molecule compound
2-oxo-2-(1H-1,2,4-triazol-3-ylamino)ethyl azepane-1-carbodithioate
Catalog ID
STK514278
SMILES O=C(Nc1n[nH]cn1)CSC(=S)N1CCCCCC1
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C11H17N5OS2 MW 299.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H17N5OS2/c17-9(14-10-12-8-13-15-10)7-19-11(18)16-5-3-1-2-4-6-16/h8H,1-7H2,(H2,12,13,14,15,17)InChIKey
PUDZBSZPAYZSFH-UHFFFAOYSA-NSynonyms
1091690-87-7(2oxo2(1H124triazol5ylamino)ethyl)azepane1carbodithioate
1091690877
2((1H124triazol3yl)amino)2oxoethylazepane1carbodithioate
2oxo2(1H124triazol3ylamino)ethylazepane1carbodithioate
C1CCCN(CC1)C(=S)SCC(=O)NC2=NC=NN2
InChI=1SC11H17N5OS2c179(1410128131510)71911(18)1653124616h8H17H2(H21213141517)
MFCD13370685
O=C(Nc1n(nH)cn1)CSC(=S)N1CCCCCC1
ZINC000019850263
ZINC19850263
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