Vitas-M small molecule compound
ethyl N-[({5-[(4-chlorophenoxy)methyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}sulfanyl)acetyl]glycinate
Catalog ID
STK588367
SMILES C=CCn1c(SCC(=O)NCC(=O)OCC)nnc1COc1ccc(cc1)Cl
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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 C18H21ClN4O4S MW 424.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21ClN4O4S/c1-3-9-23-15(11-27-14-7-5-13(19)6-8-14)21-22-18(23)28-12-16(24)20-10-17(25)26-4-2/h3,5-8H,1,4,9-12H2,2H3,(H,20,24)InChIKey
WGPBULALSGYWRC-UHFFFAOYSA-NSynonyms
896596-06-8896596068
CCOC(=O)CNC(=O)CSC1=NN=C(N1CC=C)COC2=CC=C(C=C2)Cl
ETHYL2((2((5((4CHLOROPHENOXY)METHYL)4PROP2ENYL124TRIAZOL3YL)SULFANYL)ACETYL)AMINO)ACETATE
ethyl2(2((4allyl5((4chlorophenoxy)methyl)4H124triazol3yl)thio)acetamido)acetate
ETHYL2(2((5(4CHLOROPHENOXYMETHYL)4(PROP2EN1YL)4H124TRIAZOL3YL)SULFANYL)ACETAMIDO)ACETATE
ETHYL2(2(5((4CHLOROPHENOXY)METHYL)4PROP2ENYL124TRIAZOL3YLTHIO)ACETYLAMINO)ACETATE
ethylN(((5((4chlorophenoxy)methyl)4(prop2en1yl)4H124triazol3yl)sulfanyl)acetyl)glycinate
InChI=1SC18H21ClN4O4Sc1392315(1127147513(19)6814)212218(23)281216(24)201017(25)2642h358H14912H22H3(H2024)
MFCD06593559
ZINC000004295033
ZINC04295033
ZINC4295033
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