Vitas-M small molecule compound

2-(1H-benzimidazol-2-ylsulfanyl)-N-(4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)propanamide

Catalog ID
STK215959
SMILES O=C(C(Sc1nc2c([nH]1)cccc2)C)Nc1nc2c(s1)CCCC2

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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 C17H18N4OS2 MW 358.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18N4OS2/c1-10(23-16-18-11-6-2-3-7-12(11)19-16)15(22)21-17-20-13-8-4-5-9-14(13)24-17/h2-3,6-7,10H,4-5,8-9H2,1H3,(H,18,19)(H,20,21,22)
InChIKey
GTYUOJXXGNCXGM-UHFFFAOYSA-N
Synonyms
838876-27-0
2(1Hbenzimidazol2ylsulfanyl)N(4567tetrahydro13benzothiazol2yl)propanamide
838876270
CC(C(=O)NC1=NC2=C(S1)CCCC2)SC3=NC4=CC=CC=C4N3
InChI=1SC17H18N4OS2c110(23161811623712(11)1916)15(22)21172013845914(13)2417h236710H4589H21H3(H1819)(H202122)
MFCD06633659
O=C(C(Sc1nc2c((nH)1)cccc2)C)Nc1nc2c(s1)CCCC2
ZINC000004386119
ZINC000004386120

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.