Vitas-M small molecule compound
propan-2-yl 4-(5-{(E)-[(2E)-3-cyclohexyl-4-oxo-2-(phenylimino)-1,3-thiazolidin-5-ylidene]methyl}furan-2-yl)-3-methylbenzoate
Catalog ID
STL505854
SMILES CC(OC(=O)c1ccc(c(c1)C)c1ccc(o1)/C=C\1/S/C(=N/c2ccccc2)/N(C1=O)C1CCCCC1)C
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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 C31H32N2O4S MW 528.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H32N2O4S/c1-20(2)36-30(35)22-14-16-26(21(3)18-22)27-17-15-25(37-27)19-28-29(34)33(24-12-8-5-9-13-24)31(38-28)32-23-10-6-4-7-11-23/h4,6-7,10-11,14-20,24H,5,8-9,12-13H2,1-3H3/b28-19+,32-31+InChIKey
XRBBBVQKOHJGNU-OVENYABFSA-NSynonyms
InChI=1SC31H32N2O4Sc120(2)3630(35)22141626(21(3)1822)27171525(3727)192829(34)33(24128591324)31(3828)3223106471123h4671011142024H5891213H213H3b2819+3231+
MFCD06668648
propan2yl4(5((E)((2E)3cyclohexyl4oxo2(phenylimino)13thiazolidin5ylidene)methyl)furan2yl)3methylbenzoate
ZINC000015227660
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