Vitas-M small molecule compound
(5Z)-1-(3-chlorophenyl)-2-thioxo-5-[(1,2,5-triphenyl-1H-pyrrol-3-yl)methylidene]dihydropyrimidine-4,6(1H,5H)-dione
Catalog ID
STK187984
SMILES Clc1cccc(c1)N1C(=S)NC(=O)/C(=C/c2cc(n(c2c2ccccc2)c2ccccc2)c2ccccc2)/C1=O
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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 C33H22ClN3O2S MW 560.08 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H22ClN3O2S/c34-25-15-10-18-27(21-25)37-32(39)28(31(38)35-33(37)40)19-24-20-29(22-11-4-1-5-12-22)36(26-16-8-3-9-17-26)30(24)23-13-6-2-7-14-23/h1-21H,(H,35,38,40)/b28-19-InChIKey
FOIHOJCYOOAUFD-USHMODERSA-NSynonyms
(5Z)1(3chlorophenyl)2sulfanylidene5((125triphenylpyrrol3yl)methylidene)13diazinane46dione
(5Z)1(3CHLOROPHENYL)2THIOXO5((125TRIPHENYL1HPYRROL3YL)METHYLIDENE)DIHYDROPYRIMIDINE46(1H5H)DIONE
C1=CC=C(C=C1)C2=CC(=C(N2C3=CC=CC=C3)C4=CC=CC=C4)C=C5C(=O)NC(=S)N(C5=O)C6=CC(=CC=C6)Cl
Clc1cccc(c1)N1C(=S)NC(=O)C(=Cc2cc(n(c2c2ccccc2)c2ccccc2)c2ccccc2)C1=O
InChI=1SC33H22ClN3O2Sc342515101827(2125)3732(39)28(31(38)3533(37)40)19242029(22114151222)36(26168391726)30(24)23136271423h121H(H353840)b2819
MFCD02629344
ZINC000097960901
ZINC97960901
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