Vitas-M small molecule compound
methyl 2-({[4-(pyrrolidin-1-ylcarbonyl)phenyl]carbamothioyl}amino)-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-3-carboxylate
Catalog ID
STK456188
SMILES COC(=O)c1c(NC(=S)Nc2ccc(cc2)C(=O)N2CCCC2)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 C23H27N3O3S2 MW 457.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H27N3O3S2/c1-29-22(28)19-17-7-3-2-4-8-18(17)31-20(19)25-23(30)24-16-11-9-15(10-12-16)21(27)26-13-5-6-14-26/h9-12H,2-8,13-14H2,1H3,(H2,24,25,30)InChIKey
OSTFJHQLQASQLW-UHFFFAOYSA-NSynonyms
COC(=O)C1=C(SC2=C1CCCCC2)NC(=S)NC3=CC=C(C=C3)C(=O)N4CCCC4
InChI=1SC23H27N3O3S2c12922(28)19177324818(17)3120(19)2523(30)241611915(101216)21(27)2613561426h912H281314H21H3(H2242530)
methyl2(((4(pyrrolidin1ylcarbonyl)phenyl)carbamothioyl)amino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate
methyl2((4(pyrrolidine1carbonyl)phenyl)carbamothioylamino)5678tetrahydro4Hcyclohepta(b)thiophene3carboxylate
MFCD05107957
ZINC000002858325
ZINC02858325
ZINC2858325
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