Vitas-M small molecule compound
ethyl N-({[5-(3-methylphenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)glycinate
Catalog ID
STK595152
SMILES C=CCn1c(SCC(=O)NCC(=O)OCC)nnc1c1cccc(c1)C
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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 C18H22N4O3S MW 374.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22N4O3S/c1-4-9-22-17(14-8-6-7-13(3)10-14)20-21-18(22)26-12-15(23)19-11-16(24)25-5-2/h4,6-8,10H,1,5,9,11-12H2,2-3H3,(H,19,23)InChIKey
QHGRHKOPTMPYHV-UHFFFAOYSA-NSynonyms
862107-00-4862107004
CCOC(=O)CNC(=O)CSC1=NN=C(N1CC=C)C2=CC(=CC=C2)C
ETHYL2((2((5(3METHYLPHENYL)4PROP2ENYL124TRIAZOL3YL)SULFANYL)ACETYL)AMINO)ACETATE
ethyl2(2((4allyl5(mtolyl)4H124triazol3yl)thio)acetamido)acetate
ETHYL2(2((5(3METHYLPHENYL)4(PROP2EN1YL)4H124TRIAZOL3YL)SULFANYL)ACETAMIDO)ACETATE
ETHYL2(2(5(3METHYLPHENYL)4PROP2ENYL124TRIAZOL3YLTHIO)ACETYLAMINO)ACETATE
ethylN(((5(3methylphenyl)4(prop2en1yl)4H124triazol3yl)sulfanyl)acetyl)glycinate
InChI=1SC18H22N4O3Sc1492217(1486713(3)1014)202118(22)261215(23)191116(24)2552h46810H1591112H223H3(H1923)
MFCD05686955
ZINC000005500265
ZINC05500265
ZINC5500265
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