Vitas-M small molecule compound

2-[(3-phenylpropanoyl)amino]-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide

Catalog ID
STK468959
SMILES O=C(Nc1sc2c(c1C(=O)N)CCCCC2)CCc1ccccc1

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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 C19H22N2O2S MW 342.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H22N2O2S/c20-18(23)17-14-9-5-2-6-10-15(14)24-19(17)21-16(22)12-11-13-7-3-1-4-8-13/h1,3-4,7-8H,2,5-6,9-12H2,(H2,20,23)(H,21,22)
InChIKey
KUFASKSUWUFGJH-UHFFFAOYSA-N
Synonyms

2((3phenylpropanoyl)amino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxamide
2(3phenylpropanoylamino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxamide
C1CCC2=C(CC1)SC(=C2C(=O)N)NC(=O)CCC3=CC=CC=C3
InChI=1SC19H22N2O2Sc2018(23)171495261015(14)2419(17)2116(22)1211137314813h13478H256912H2(H22023)(H2122)
MFCD03382973
ZINC000004176882
ZINC04176882
ZINC4176882

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Available files

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