Vitas-M small molecule compound

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

Catalog ID
STK390738
SMILES O=C(c1ccc(c(c1)C)C)Nc1sc2c(c1C(=O)N)CCCCC2

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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/c1-11-8-9-13(10-12(11)2)18(23)21-19-16(17(20)22)14-6-4-3-5-7-15(14)24-19/h8-10H,3-7H2,1-2H3,(H2,20,22)(H,21,23)
InChIKey
CXMPWDKLMNVJQB-UHFFFAOYSA-N
Synonyms
321532-71-2
2(((34dimethylphenyl)carbonyl)amino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxamide
2((34dimethylbenzoyl)amino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxamide
321532712
CC1=C(C=C(C=C1)C(=O)NC2=C(C3=C(S2)CCCCC3)C(=O)N)C
InChI=1SC19H22N2O2Sc1118913(1012(11)2)18(23)211916(17(20)22)146435715(14)2419h810H37H212H3(H22022)(H2123)
MFCD01349404
ZINC000000029065
ZINC00029065
ZINC29065

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Available files

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