Vitas-M small molecule compound

{5-[(4-chlorophenyl)amino]-1H-1,2,3-triazol-4-yl}(thiomorpholin-4-yl)methanone

Catalog ID
STL098812
SMILES Clc1ccc(cc1)Nc1[nH]nnc1C(=O)N1CCSCC1

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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 C13H14ClN5OS MW 323.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H14ClN5OS/c14-9-1-3-10(4-2-9)15-12-11(16-18-17-12)13(20)19-5-7-21-8-6-19/h1-4H,5-8H2,(H2,15,16,17,18)
InChIKey
WTSKCHBHFHMQQY-UHFFFAOYSA-N
Synonyms
1291860-84-8
(5((4chlorophenyl)amino)1H123triazol4yl)(thiomorpholin4yl)methanone
(5(4chloroanilino)2Htriazol4yl)thiomorpholin4ylmethanone
1291860848
C1CSCCN1C(=O)C2=NNN=C2NC3=CC=C(C=C3)Cl
Clc1ccc(cc1)Nc1(nH)nnc1C(=O)N1CCSCC1
InChI=1SC13H14ClN5OSc1491310(429)151211(16181712)13(20)1957218619h14H58H2(H215161718)
MFCD18790055
ZINC000067284294
ZINC67284294

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Available files

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