Vitas-M small molecule compound
N-(1,3-benzodioxol-5-yl)-2-{[5-(4-chlorophenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Catalog ID
STL293796
SMILES C=CCn1c(SCC(=O)Nc2ccc3c(c2)OCO3)nnc1c1ccc(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 C20H17ClN4O3S MW 428.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H17ClN4O3S/c1-2-9-25-19(13-3-5-14(21)6-4-13)23-24-20(25)29-11-18(26)22-15-7-8-16-17(10-15)28-12-27-16/h2-8,10H,1,9,11-12H2,(H,22,26)InChIKey
RLZJXILQUNOSAJ-UHFFFAOYSA-NSynonyms
775317-28-72((4allyl5(4chlorophenyl)4H124triazol3yl)thio)N(benzo(d)(13)dioxol5yl)acetamide
775317287
C=CCN1C(=NN=C1SCC(=O)NC2=CC3=C(C=C2)OCO3)C4=CC=C(C=C4)Cl
InChI=1SC20H17ClN4O3Sc1292519(133514(21)6413)232420(25)291118(26)2215781617(1015)28122716h2810H191112H2(H2226)
MFCD05514680
N(13benzodioxol5yl)2((5(4chlorophenyl)4(prop2en1yl)4H124triazol3yl)sulfanyl)acetamide
N(13BENZODIOXOL5YL)2((5(4CHLOROPHENYL)4PROP2ENYL124TRIAZOL3YL)SULFANYL)ACETAMIDE
ZINC000002658129
ZINC02658129
ZINC2658129
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