Vitas-M small molecule compound
ethyl 3,3-diethyl-1-{[(phenylcarbonyl)carbamothioyl]amino}-3,4-dihydronaphthalene-2-carboxylate
Catalog ID
STK830682
SMILES CCOC(=O)C1=C(NC(=S)NC(=O)c2ccccc2)c2ccccc2CC1(CC)CC
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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 C25H28N2O3S MW 436.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H28N2O3S/c1-4-25(5-2)16-18-14-10-11-15-19(18)21(20(25)23(29)30-6-3)26-24(31)27-22(28)17-12-8-7-9-13-17/h7-15H,4-6,16H2,1-3H3,(H2,26,27,28,31)InChIKey
QSPZMPYGNWOLPE-UHFFFAOYSA-NSynonyms
332167-99-4332167994
CCC1(CC2=CC=CC=C2C(=C1C(=O)OCC)NC(=S)NC(=O)C3=CC=CC=C3)CC
ETHYL1((BENZOYLCARBAMOTHIOYL)AMINO)33DIETHYL34DIHYDRONAPHTHALENE2CARBOXYLATE
ethyl1(3benzoylthioureido)33diethyl34dihydronaphthalene2carboxylate
ETHYL1(BENZOYLCARBAMOTHIOYLAMINO)33DIETHYL4HNAPHTHALENE2CARBOXYLATE
ethyl33diethyl1(((phenylcarbonyl)carbamothioyl)amino)34dihydronaphthalene2carboxylate
ETHYL33DIETHYL1(((PHENYLCARBONYLAMINO)THIOXOMETHYL)AMINO)34DIHYDRONAPHTHALENE2CARBOXYLATE
InChI=1SC25H28N2O3Sc1425(52)16181410111519(18)21(20(25)23(29)3063)2624(31)2722(28)17128791317h715H4616H213H3(H226272831)
MFCD01557089
ZINC000002315009
ZINC02315009
ZINC2315009
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