Vitas-M small molecule compound
N-[2-(2-{(Z)-[1-(2-methylphenyl)-4,6-dioxo-2-sulfanyl-1,6-dihydropyrimidin-5(4H)-ylidene]methyl}-1H-indol-3-yl)ethyl]acetamide
Catalog ID
STL047119
SMILES CC(=O)NCCc1c(/C=C\2/C(=O)N=C(N(C2=O)c2ccccc2C)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 C24H22N4O3S MW 446.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22N4O3S/c1-14-7-3-6-10-21(14)28-23(31)18(22(30)27-24(28)32)13-20-17(11-12-25-15(2)29)16-8-4-5-9-19(16)26-20/h3-10,13,26H,11-12H2,1-2H3,(H,25,29)(H,27,30,32)/b18-13-InChIKey
RMIIUIAESFMXBW-AQTBWJFISA-NSynonyms
CC(=O)NCCc1c(C=C2C(=O)N=C(N(C2=O)c2ccccc2C)S)(nH)c2c1cccc2
CC1=CC=CC=C1N2C(=O)C(=CC3=C(C4=CC=CC=C4N3)CCNC(=O)C)C(=O)NC2=S
InChI=1SC24H22N4O3Sc1147361021(14)2823(31)18(22(30)2724(28)32)132017(11122515(2)29)16845919(16)2620h3101326H1112H212H3(H2529)(H273032)b1813
MFCD04073275
N(2(2((Z)(1(2methylphenyl)46dioxo2sulfanyl16dihydropyrimidin5(4H)ylidene)methyl)1Hindol3yl)ethyl)acetamide
N(2(2((Z)(1(2METHYLPHENYL)46DIOXO2SULFANYLIDENE13DIAZINAN5YLIDENE)METHYL)1HINDOL3YL)ETHYL)ACETAMIDE
ZINC000009209769
ZINC09209769
ZINC17194743
ZINC9209769
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