Vitas-M small molecule compound
(5Z)-5-{[2,5-dimethyl-1-(4-methylphenyl)-1H-pyrrol-3-yl]methylidene}-1-(naphthalen-1-yl)-2-sulfanylpyrimidine-4,6(1H,5H)-dione
Catalog ID
STL051086
SMILES Cc1ccc(cc1)n1c(C)cc(c1C)/C=C\1/C(=O)N=C(N(C1=O)c1cccc2c1cccc2)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 C28H23N3O2S MW 465.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H23N3O2S/c1-17-11-13-22(14-12-17)30-18(2)15-21(19(30)3)16-24-26(32)29-28(34)31(27(24)33)25-10-6-8-20-7-4-5-9-23(20)25/h4-16H,1-3H3,(H,29,32,34)/b24-16-InChIKey
GCCZAKFCMPMLNS-JLPGSUDCSA-NSynonyms
587004-40-8(5Z)5((25dimethyl1(4methylphenyl)1Hpyrrol3yl)methylidene)1(naphthalen1yl)2sulfanylpyrimidine46(1H5H)dione
(5Z)5((25DIMETHYL1(4METHYLPHENYL)PYRROL3YL)METHYLIDENE)1NAPHTHALEN1YL2SULFANYLIDENE13DIAZINANE46DIONE
587004408
CC1=CC=C(C=C1)N2C(=CC(=C2C)C=C3C(=O)NC(=S)N(C3=O)C4=CC=CC5=CC=CC=C54)C
Cc1ccc(cc1)n1c(C)cc(c1C)C=C1C(=O)N=C(N(C1=O)c1cccc2c1cccc2)S
InChI=1SC28H23N3O2Sc117111322(141217)3018(2)1521(19(30)3)162426(32)2928(34)31(27(24)33)25106820745923(20)25h416H13H3(H293234)b2416
MFCD05732245
ZINC000002394410
ZINC02394410
ZINC17248281
ZINC2394410
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