Vitas-M small molecule compound
4-{[({5-[(4-chlorophenoxy)methyl]-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl}sulfanyl)acetyl]amino}benzamide
Catalog ID
STK576279
SMILES C=CCn1c(SCC(=O)Nc2ccc(cc2)C(=O)N)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 C21H20ClN5O3S MW 457.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20ClN5O3S/c1-2-11-27-18(12-30-17-9-5-15(22)6-10-17)25-26-21(27)31-13-19(28)24-16-7-3-14(4-8-16)20(23)29/h2-10H,1,11-13H2,(H2,23,29)(H,24,28)InChIKey
ZRULWMLYTMHRKR-UHFFFAOYSA-NSynonyms
896841-86-44((((5((4chlorophenoxy)methyl)4(prop2en1yl)4H124triazol3yl)sulfanyl)acetyl)amino)benzamide
4((2((5((4CHLOROPHENOXY)METHYL)4PROP2ENYL124TRIAZOL3YL)SULFANYL)ACETYL)AMINO)BENZAMIDE
4(2((4allyl5((4chlorophenoxy)methyl)4H124triazol3yl)thio)acetamido)benzamide
4(2((5(4CHLOROPHENOXYMETHYL)4(PROP2EN1YL)4H124TRIAZOL3YL)SULFANYL)ACETAMIDO)BENZAMIDE
4(2(5((4CHLOROPHENOXY)METHYL)4PROP2ENYL124TRIAZOL3YLTHIO)ACETYLAMINO)BENZAMIDE
896841864
C=CCN1C(=NN=C1SCC(=O)NC2=CC=C(C=C2)C(=O)N)COC3=CC=C(C=C3)Cl
InChI=1SC21H20ClN5O3Sc12112718(1230179515(22)61017)252621(27)311319(28)24167314(4816)20(23)29h210H11113H2(H22329)(H2428)
MFCD06601255
ZINC000002227995
ZINC02227995
ZINC2227995
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