Vitas-M small molecule compound

methyl 2-{[(pyridin-2-ylmethyl)carbamoyl]amino}-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxylate

Catalog ID
STK616574
SMILES COC(=O)c1c(NC(=O)NCc2ccccn2)sc2c1CCC2

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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 C16H17N3O3S MW 331.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17N3O3S/c1-22-15(20)13-11-6-4-7-12(11)23-14(13)19-16(21)18-9-10-5-2-3-8-17-10/h2-3,5,8H,4,6-7,9H2,1H3,(H2,18,19,21)
InChIKey
BDEUYLUSLUZYJQ-UHFFFAOYSA-N
Synonyms
904510-63-0
904510630
COC(=O)C1=C(SC2=C1CCC2)NC(=O)NCC3=CC=CC=N3
InChI=1SC16H17N3O3Sc12215(20)131164712(11)2314(13)1916(21)1891052381710h2358H4679H21H3(H2181921)
methyl2(((pyridin2ylmethyl)carbamoyl)amino)56dihydro4Hcyclopenta(b)thiophene3carboxylate
methyl2(3(pyridin2ylmethyl)ureido)56dihydro4Hcyclopenta(b)thiophene3carboxylate
METHYL2(PYRIDIN2YLMETHYLCARBAMOYLAMINO)56DIHYDRO4HCYCLOPENTA(B)THIOPHENE3CARBOXYLATE
MFCD08284935
ZINC000006661331
ZINC06661331
ZINC6661331

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Available files

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