Vitas-M small molecule compound
(5Z)-5-{[1-(4-chlorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-1-ethyl-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Catalog ID
STL056514
SMILES CCN1C(=NC(=O)/C(=C/c2cc(n(c2C)c2ccc(cc2)Cl)C)/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 C19H18ClN3O2S MW 387.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18ClN3O2S/c1-4-22-18(25)16(17(24)21-19(22)26)10-13-9-11(2)23(12(13)3)15-7-5-14(20)6-8-15/h5-10H,4H2,1-3H3,(H,21,24,26)/b16-10-InChIKey
NSHOCVCLIRSZMM-YBEGLDIGSA-NSynonyms
639789-59-6(5Z)5((1(4chlorophenyl)25dimethyl1Hpyrrol3yl)methylidene)1ethyl2sulfanylpyrimidine46(1H5H)dione
(5Z)5((1(4CHLOROPHENYL)25DIMETHYLPYRROL3YL)METHYLIDENE)1ETHYL2SULFANYLIDENE13DIAZINANE46DIONE
639789596
CCN1C(=NC(=O)C(=Cc2cc(n(c2C)c2ccc(cc2)Cl)C)C1=O)S
CCN1C(=O)C(=CC2=C(N(C(=C2)C)C3=CC=C(C=C3)Cl)C)C(=O)NC1=S
InChI=1SC19H18ClN3O2Sc142218(25)16(17(24)2119(22)26)1013911(2)23(12(13)3)157514(20)6815h510H4H213H3(H212426)b1610
MFCD05734642
ZINC000009361104
ZINC09361104
ZINC9361104
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