Vitas-M small molecule compound
(5E)-1-(4-chlorophenyl)-3-ethyl-5-(1H-indol-3-ylmethylidene)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK198012
SMILES CCN1C(=O)/C(=C\c2c[nH]c3c2cccc3)/C(=O)N(C1=S)c1ccc(cc1)Cl
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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 C21H16ClN3O2S MW 409.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16ClN3O2S/c1-2-24-19(26)17(11-13-12-23-18-6-4-3-5-16(13)18)20(27)25(21(24)28)15-9-7-14(22)8-10-15/h3-12,23H,2H2,1H3/b17-11+InChIKey
BDGIFPMWIMTBLK-GZTJUZNOSA-NSynonyms
(5E)1(4CHLOROPHENYL)3ETHYL5(1HINDOL3YLMETHYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
(5E)1(4CHLOROPHENYL)3ETHYL5(1HINDOL3YLMETHYLIDENE)2THIOXODIHYDROPYRIMIDINE46(1H5H)DIONE
CCN1C(=O)C(=CC2=CNC3=CC=CC=C32)C(=O)N(C1=S)C4=CC=C(C=C4)Cl
CCN1C(=O)C(=Cc2c(nH)c3c2cccc3)C(=O)N(C1=S)c1ccc(cc1)Cl
InChI=1SC21H16ClN3O2Sc122419(26)17(1113122318643516(13)18)20(27)25(21(24)28)159714(22)81015h31223H2H21H3b1711+
MFCD03696733
ZINC000004739145
ZINC04739145
ZINC4739145
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