Vitas-M small molecule compound
ethyl 2-({[(2-methylphenyl)carbonyl]carbamothioyl}amino)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Catalog ID
STK317665
SMILES CCOC(=O)c1c(NC(=S)NC(=O)c2ccccc2C)sc2c1CCCCC2
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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 C21H24N2O3S2 MW 416.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N2O3S2/c1-3-26-20(25)17-15-11-5-4-6-12-16(15)28-19(17)23-21(27)22-18(24)14-10-8-7-9-13(14)2/h7-10H,3-6,11-12H2,1-2H3,(H2,22,23,24,27)InChIKey
RZIYSIVHKHQZDZ-UHFFFAOYSA-NSynonyms
445237-12-7445237127
CCOC(=O)C1=C(SC2=C1CCCCC2)NC(=S)NC(=O)C3=CC=CC=C3C
ethyl2((((2methylphenyl)carbonyl)carbamothioyl)amino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate
ethyl2((2methylbenzoyl)carbamothioylamino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate
InChI=1SC21H24N2O3S2c132620(25)1715115461216(15)2819(17)2321(27)2218(24)141087913(14)2h710H361112H212H3(H222232427)
MFCD02374412
ZINC000000649462
ZINC00649462
ZINC649462
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