Vitas-M small molecule compound
ethyl 2-{[(phenylcarbonyl)carbamothioyl]amino}-4,7-dihydro-5H-spiro[1-benzothiophene-6,1'-cyclohexane]-3-carboxylate
Catalog ID
STL249480
SMILES CCOC(=O)c1c(NC(=S)NC(=O)c2ccccc2)sc2c1CCC1(C2)CCCCC1
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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 C24H28N2O3S2 MW 456.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H28N2O3S2/c1-2-29-22(28)19-17-11-14-24(12-7-4-8-13-24)15-18(17)31-21(19)26-23(30)25-20(27)16-9-5-3-6-10-16/h3,5-6,9-10H,2,4,7-8,11-15H2,1H3,(H2,25,26,27,30)InChIKey
IJVIDJVOTAVTKD-UHFFFAOYSA-NSynonyms
330819-70-0330819700
CCOC(=O)C1=C(SC2=C1CCC3(C2)CCCCC3)NC(=S)NC(=O)C4=CC=CC=C4
ethyl2(((phenylcarbonyl)carbamothioyl)amino)47dihydro5Hspiro(1benzothiophene61cyclohexane)3carboxylate
ethyl2(3benzoylthioureido)57dihydro4Hspiro(benzo(b)thiophene61cyclohexane)3carboxylate
ETHYL2(BENZOYLCARBAMOTHIOYLAMINO)SPIRO(57DIHYDRO4H1BENZOTHIOPHENE61CYCLOHEXANE)3CARBOXYLATE
InChI=1SC24H28N2O3S2c122922(28)1917111424(127481324)1518(17)3121(19)2623(30)2520(27)1695361016h356910H24781115H21H3(H225262730)
MFCD00330693
ZINC000002273787
ZINC02273787
ZINC2273787
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