Vitas-M small molecule compound
N-{[5-({2-[(4-fluoro-2-methylphenyl)amino]-2-oxoethyl}sulfanyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]methyl}furan-2-carboxamide
Catalog ID
STK498182
SMILES C=CCn1c(SCC(=O)Nc2ccc(cc2C)F)nnc1CNC(=O)c1ccco1
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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 C20H20FN5O3S MW 429.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20FN5O3S/c1-3-8-26-17(11-22-19(28)16-5-4-9-29-16)24-25-20(26)30-12-18(27)23-15-7-6-14(21)10-13(15)2/h3-7,9-10H,1,8,11-12H2,2H3,(H,22,28)(H,23,27)InChIKey
CMUZIWDYACYGCD-UHFFFAOYSA-NSynonyms
CC1=C(C=CC(=C1)F)NC(=O)CSC2=NN=C(N2CC=C)CNC(=O)C3=CC=CO3
InChI=1SC20H20FN5O3Sc1382617(112219(28)165492916)242520(26)301218(27)23157614(21)1013(15)2h37910H181112H22H3(H2228)(H2327)
MFCD11855349
N((5((2((4fluoro2methylphenyl)amino)2oxoethyl)sulfanyl)4(prop2en1yl)4H124triazol3yl)methyl)furan2carboxamide
N((5(2(4fluoro2methylanilino)2oxoethyl)sulfanyl4prop2enyl124triazol3yl)methyl)furan2carboxamide
ZINC000032579615
ZINC32579615
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