Vitas-M small molecule compound
N-(2-ethylphenyl)-2-[5-{[2-(morpholin-4-yl)-2-oxoethyl]sulfanyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]acetamide
Catalog ID
STK261086
SMILES C=CCn1c(nnc1SCC(=O)N1CCOCC1)CC(=O)Nc1ccccc1CC
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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 C21H27N5O3S MW 429.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27N5O3S/c1-3-9-26-18(14-19(27)22-17-8-6-5-7-16(17)4-2)23-24-21(26)30-15-20(28)25-10-12-29-13-11-25/h3,5-8H,1,4,9-15H2,2H3,(H,22,27)InChIKey
NESAYKKUOBBEAG-UHFFFAOYSA-NSynonyms
CCC1=CC=CC=C1NC(=O)CC2=NN=C(N2CC=C)SCC(=O)N3CCOCC3
InChI=1SC21H27N5O3Sc1392618(1419(27)2217865716(17)42)232421(26)301520(28)25101229131125h358H14915H22H3(H2227)
MFCD08670391
N(2ETHYLPHENYL)2(5((2(MORPHOLIN4YL)2OXOETHYL)SULFANYL)4(PROP2EN1YL)4H124TRIAZOL3YL)ACETAMIDE
N(2ethylphenyl)2(5(2morpholin4yl2oxoethyl)sulfanyl4prop2enyl124triazol3yl)acetamide
ZINC000009426778
ZINC09426778
ZINC9426778
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