Vitas-M small molecule compound

Catalog ID
STK786337
SMILES COc1ccc(cc1)C1=NO[C@@H]2C1/C(=N/NC(=S)C)/[C@H]1OC2CO1

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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 C16H17N3O4S MW 347.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17N3O4S/c1-8(24)17-18-14-12-13(9-3-5-10(20-2)6-4-9)19-23-15(12)11-7-21-16(14)22-11/h3-6,11-12,15-16H,7H2,1-2H3,(H,17,24)/b18-14-/t11?,12?,15-,16-/m1/s1
InChIKey
WKUKFHWOJANEEF-MILCXBAUSA-N
Synonyms

COc1ccc(cc1)C1=NO(C@@H)2C1C(=NNC(=S)C)(C@H)1OC2CO1
MFCD08532232
ZINC000006668863
ZINC000012364777

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Available files

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