Vitas-M small molecule compound

3-chloro-N-[(pyridin-3-ylmethyl)carbamothioyl]-1-benzothiophene-2-carboxamide

Catalog ID
STL068083
SMILES S=C(NC(=O)c1sc2c(c1Cl)cccc2)NCc1cccnc1

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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 C16H12ClN3OS2 MW 361.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12ClN3OS2/c17-13-11-5-1-2-6-12(11)23-14(13)15(21)20-16(22)19-9-10-4-3-7-18-8-10/h1-8H,9H2,(H2,19,20,21,22)
InChIKey
ICZUASXGMNBUNO-UHFFFAOYSA-N
Synonyms

3chloroN((pyridin3ylmethyl)carbamothioyl)1benzothiophene2carboxamide
3chloroN(pyridin3ylmethylcarbamothioyl)1benzothiophene2carboxamide
C1=CC=C2C(=C1)C(=C(S2)C(=O)NC(=S)NCC3=CN=CC=C3)Cl
InChI=1SC16H12ClN3OS2c171311512612(11)2314(13)15(21)2016(22)1991043718810h18H9H2(H219202122)
MFCD09440124
N((3CHLORO1BENZOTHIEN2YL)CARBONYL)N(3PYRIDINYLMETHYL)THIOUREA
ZINC000012138723
ZINC12138723

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Available files

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