Vitas-M small molecule compound

ethyl 3-cyclohexyl-3-methyl-1-{[(phenylcarbonyl)carbamothioyl]amino}-3,4-dihydronaphthalene-2-carboxylate

Catalog ID
STK532385
SMILES CCOC(=O)C1=C(NC(=S)NC(=O)c2ccccc2)c2ccccc2CC1(C)C1CCCCC1

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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 C28H32N2O3S MW 476.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H32N2O3S/c1-3-33-26(32)23-24(29-27(34)30-25(31)19-12-6-4-7-13-19)22-17-11-10-14-20(22)18-28(23,2)21-15-8-5-9-16-21/h4,6-7,10-14,17,21H,3,5,8-9,15-16,18H2,1-2H3,(H2,29,30,31,34)
InChIKey
QXFKRJBIFKLOSP-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(C2=CC=CC=C2CC1(C)C3CCCCC3)NC(=S)NC(=O)C4=CC=CC=C4
ethyl1(3benzoylthioureido)3cyclohexyl3methyl34dihydronaphthalene2carboxylate
ETHYL1(BENZOYLCARBAMOTHIOYLAMINO)3CYCLOHEXYL3METHYL4HNAPHTHALENE2CARBOXYLATE
ethyl3cyclohexyl3methyl1(((phenylcarbonyl)carbamothioyl)amino)34dihydronaphthalene2carboxylate
InChI=1SC28H32N2O3Sc133326(32)2324(2927(34)3025(31)19126471319)221711101420(22)1828(232)21158591621h46710141721H3589151618H212H3(H229303134)
MFCD02989777
ZINC000009186686
ZINC000009186687

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Available files

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