Vitas-M small molecule compound

N-[2-(2-{(Z)-[1-(4-fluorobenzyl)-4,6-dioxo-2-sulfanyl-1,6-dihydropyrimidin-5(4H)-ylidene]methyl}-1H-indol-3-yl)ethyl]acetamide

Catalog ID
STL053640
SMILES CC(=O)NCCc1c(/C=C\2/C(=O)N=C(N(C2=O)Cc2ccc(cc2)F)S)[nH]c2c1cccc2

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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 C24H21FN4O3S MW 464.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H21FN4O3S/c1-14(30)26-11-10-18-17-4-2-3-5-20(17)27-21(18)12-19-22(31)28-24(33)29(23(19)32)13-15-6-8-16(25)9-7-15/h2-9,12,27H,10-11,13H2,1H3,(H,26,30)(H,28,31,33)/b19-12-
InChIKey
QQZOKHYALMPTDM-UNOMPAQXSA-N
Synonyms

CC(=O)NCCC1=C(NC2=CC=CC=C21)C=C3C(=O)NC(=S)N(C3=O)CC4=CC=C(C=C4)F
CC(=O)NCCc1c(C=C2C(=O)N=C(N(C2=O)Cc2ccc(cc2)F)S)(nH)c2c1cccc2
InChI=1SC24H21FN4O3Sc114(30)2611101817423520(17)2721(18)121922(31)2824(33)29(23(19)32)13156816(25)9715h291227H101113H21H3(H2630)(H283133)b1912
MFCD05730801
N(2(2((Z)(1((4FLUOROPHENYL)METHYL)46DIOXO2SULFANYLIDENE13DIAZINAN5YLIDENE)METHYL)1HINDOL3YL)ETHYL)ACETAMIDE
N(2(2((Z)(1(4fluorobenzyl)46dioxo2sulfanyl16dihydropyrimidin5(4H)ylidene)methyl)1Hindol3yl)ethyl)acetamide
ZINC000001269828
ZINC01269828
ZINC1269828
ZINC13806690

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Available files

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