Vitas-M small molecule compound
2-[(phenylcarbonyl)amino]-N-(pyridin-2-yl)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxamide
Catalog ID
STK082106
SMILES O=C(c1c(sc2c1CCCCC2)NC(=O)c1ccccc1)Nc1ccccn1
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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 C22H21N3O2S MW 391.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21N3O2S/c26-20(15-9-3-1-4-10-15)25-22-19(16-11-5-2-6-12-17(16)28-22)21(27)24-18-13-7-8-14-23-18/h1,3-4,7-10,13-14H,2,5-6,11-12H2,(H,25,26)(H,23,24,27)InChIKey
DWALMTZTPJNLJA-UHFFFAOYSA-NSynonyms
2((phenylcarbonyl)amino)N(pyridin2yl)5678tetrahydro4Hcyclohepta(b)thiophene3carboxamide
2benzamidoNpyridin2yl5678tetrahydro4Hcyclohepta(b)thiophene3carboxamide
C1CCC2=C(CC1)SC(=C2C(=O)NC3=CC=CC=N3)NC(=O)C4=CC=CC=C4
InChI=1SC22H21N3O2Sc2620(1593141015)252219(16115261217(16)2822)21(27)24181378142318h1347101314H2561112H2(H2526)(H232427)
MFCD02053342
O=C(c1c(sc2c1CCCCC2)NC(=O)c1ccccc1)Nc1ccccn1
STK082106
ZINC000001081678
ZINC01081678
ZINC1081678
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