Vitas-M small molecule compound

cyclohexylmethyl 3-methyl-4-oxo-6-(thiophen-2-yl)-4,5,6,7-tetrahydro-1H-indole-2-carboxylate

Catalog ID
STK405447
SMILES O=C(c1[nH]c2c(c1C)C(=O)CC(C2)c1cccs1)OCC1CCCCC1

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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 C21H25NO3S MW 371.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25NO3S/c1-13-19-16(10-15(11-17(19)23)18-8-5-9-26-18)22-20(13)21(24)25-12-14-6-3-2-4-7-14/h5,8-9,14-15,22H,2-4,6-7,10-12H2,1H3
InChIKey
KOUGJIOLVRHYQJ-UHFFFAOYSA-N
Synonyms

CC1=C(NC2=C1C(=O)CC(C2)C3=CC=CS3)C(=O)OCC4CCCCC4
CYCLOHEXYLMETHYL3METHYL4OXO6(2THIENYL)567TRIHYDROINDOLE2CARBOXYLATE
cyclohexylmethyl3methyl4oxo6(thiophen2yl)4567tetrahydro1Hindole2carboxylate
cyclohexylmethyl3methyl4oxo6thiophen2yl1567tetrahydroindole2carboxylate
InChI=1SC21H25NO3Sc1131916(1015(1117(19)23)188592618)2220(13)21(24)2512146324714h589141522H24671012H21H3
MFCD06651821
ZINC000006819382
ZINC000006819383

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Available files

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