Vitas-M small molecule compound
(5Z)-1-(3,5-dimethylphenyl)-5-{[(2-phenylethyl)amino]methylidene}-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Catalog ID
STL056586
SMILES Cc1cc(C)cc(c1)N1C(=NC(=O)/C(=C/NCCc2ccccc2)/C1=O)S
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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 C21H21N3O2S MW 379.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N3O2S/c1-14-10-15(2)12-17(11-14)24-20(26)18(19(25)23-21(24)27)13-22-9-8-16-6-4-3-5-7-16/h3-7,10-13,22H,8-9H2,1-2H3,(H,23,25,27)/b18-13-InChIKey
JZTWTWZSWPYUDT-AQTBWJFISA-NSynonyms
(5Z)1(35dimethylphenyl)5(((2phenylethyl)amino)methylidene)2sulfanylpyrimidine46(1H5H)dione
(5Z)1(35dimethylphenyl)5((2phenylethylamino)methylidene)2sulfanylidene13diazinane46dione
(5Z)1(35DIMETHYLPHENYL)5((PHENETHYLAMINO)METHYLIDENE)2SULFANYLIDENE13DIAZINANE46DIONE
Cc1cc(C)cc(c1)N1C(=NC(=O)C(=CNCCc2ccccc2)C1=O)S
InChI=1SC21H21N3O2Sc1141015(2)1217(1114)2420(26)18(19(25)2321(24)27)132298166435716h37101322H89H212H3(H232527)b1813
MFCD05726472
ZINC000005886060
ZINC5886060
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