Vitas-M small molecule compound

3-amino-N-(2-chlorophenyl)-5,6,7,8,9,10-hexahydrocycloocta[b]thieno[3,2-e]pyridine-2-carboxamide

Catalog ID
STK788824
SMILES Clc1ccccc1NC(=O)c1sc2c(c1N)cc1c(n2)CCCCCC1

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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 C20H20ClN3OS MW 385.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20ClN3OS/c21-14-8-5-6-10-16(14)23-19(25)18-17(22)13-11-12-7-3-1-2-4-9-15(12)24-20(13)26-18/h5-6,8,10-11H,1-4,7,9,22H2,(H,23,25)
InChIKey
LOCUPUCGSDKJSM-UHFFFAOYSA-N
Synonyms
496788-10-4
3aminoN(2chlorophenyl)5678910hexahydrocycloocta(b)thieno(32e)pyridine2carboxamide
496788104
C1CCCC2=C(CC1)C=C3C(=C(SC3=N2)C(=O)NC4=CC=CC=C4Cl)N
InChI=1SC20H20ClN3OSc21148561016(14)2319(25)1817(22)13111273124915(12)2420(13)2618h5681011H147922H2(H2325)
MFCD03235842
ZINC000000691606
ZINC00691606
ZINC691606

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Available files

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