Vitas-M small molecule compound
2-{[5-(2-chlorophenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[4-(propan-2-yl)phenyl]acetamide
Catalog ID
STK139971
SMILES O=C(Nc1ccc(cc1)C(C)C)CSc1nnc(n1C)c1ccccc1Cl
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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 C20H21ClN4OS MW 400.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21ClN4OS/c1-13(2)14-8-10-15(11-9-14)22-18(26)12-27-20-24-23-19(25(20)3)16-6-4-5-7-17(16)21/h4-11,13H,12H2,1-3H3,(H,22,26)InChIKey
BFWWANNXEXSACU-UHFFFAOYSA-NSynonyms
2((5(2CHLOROPHENYL)4METHYL124TRIAZOL3YL)SULFANYL)N(4PROPAN2YLPHENYL)ACETAMIDE
2((5(2CHLOROPHENYL)4METHYL4H124TRIAZOL3YL)SULFANYL)N(4(PROPAN2YL)PHENYL)ACETAMIDE
CC(C)C1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2C)C3=CC=CC=C3Cl
InChI=1SC20H21ClN4OSc113(2)1481015(11914)2218(26)122720242319(25(20)3)16645717(16)21h41113H12H213H3(H2226)
MFCD04212701
ZINC000002841030
ZINC02841030
ZINC2841030
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