Vitas-M small molecule compound

1-(3-chlorophenyl)-3-(4,5,6,7-tetrahydro-1-benzothiophen-3-ylmethyl)urea

Catalog ID
STK666269
SMILES O=C(Nc1cccc(c1)Cl)NCc1csc2c1CCCC2

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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 C16H17ClN2OS MW 320.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17ClN2OS/c17-12-4-3-5-13(8-12)19-16(20)18-9-11-10-21-15-7-2-1-6-14(11)15/h3-5,8,10H,1-2,6-7,9H2,(H2,18,19,20)
InChIKey
KPOMDRYNWRCSHQ-UHFFFAOYSA-N
Synonyms

1(3chlorophenyl)3(4567tetrahydro1benzothiophen3ylmethyl)urea
C1CCC2=C(C1)C(=CS2)CNC(=O)NC3=CC(=CC=C3)Cl
InChI=1SC16H17ClN2OSc171243513(812)1916(20)18911102115721614(11)15h35810H12679H2(H2181920)
MFCD07657871
ZINC000004776516
ZINC04776516
ZINC4776516

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Available files

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