Vitas-M small molecule compound
(5Z)-5-{[1-(2-methoxyethyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-1-(prop-2-en-1-yl)-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Catalog ID
STL042545
SMILES COCCn1c(C)cc(c1C)/C=C\1/C(=O)N=C(N(C1=O)CC=C)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 C17H21N3O3S MW 347.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H21N3O3S/c1-5-6-20-16(22)14(15(21)18-17(20)24)10-13-9-11(2)19(12(13)3)7-8-23-4/h5,9-10H,1,6-8H2,2-4H3,(H,18,21,24)/b14-10-InChIKey
UGKHROOPTYBWEM-UVTDQMKNSA-NSynonyms
(5Z)5((1(2methoxyethyl)25dimethyl1Hpyrrol3yl)methylidene)1(prop2en1yl)2sulfanylpyrimidine46(1H5H)dione
(5Z)5((1(2METHOXYETHYL)25DIMETHYLPYRROL3YL)METHYLIDENE)1PROP2ENYL2SULFANYLIDENE13DIAZINANE46DIONE
CC1=CC(=C(N1CCOC)C)C=C2C(=O)NC(=S)N(C2=O)CC=C
COCCn1c(C)cc(c1C)C=C1C(=O)N=C(N(C1=O)CC=C)S
InChI=1SC17H21N3O3Sc1562016(22)14(15(21)1817(20)24)1013911(2)19(12(13)3)78234h5910H168H224H3(H182124)b1410
MFCD05728350
ZINC000017208322
ZINC17208322
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