Vitas-M small molecule compound
N-(4-acetylphenyl)-2-{[5-(4-aminophenyl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}butanamide
Catalog ID
STK013910
SMILES CCC(C(=O)Nc1ccc(cc1)C(=O)C)Sc1nnc(n1C)c1ccc(cc1)N
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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 C21H23N5O2S MW 409.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N5O2S/c1-4-18(20(28)23-17-11-7-14(8-12-17)13(2)27)29-21-25-24-19(26(21)3)15-5-9-16(22)10-6-15/h5-12,18H,4,22H2,1-3H3,(H,23,28)InChIKey
CIFJDUFAQIUCPX-UHFFFAOYSA-NSynonyms
488136-35-2488136352
CCC(C(=O)NC1=CC=C(C=C1)C(=O)C)SC2=NN=C(N2C)C3=CC=C(C=C3)N
CCC(C(=O)Nc1ccc(cc1)C(=O)C)Sc1nnc(n1C)c1ccc(cc1)N
InChI=1SC21H23N5O2Sc1418(20(28)231711714(81217)13(2)27)2921252419(26(21)3)155916(22)10615h51218H422H213H3(H2328)
MFCD03273390
N(4ACETYLPHENYL)2((5(4AMINOPHENYL)4METHYL124TRIAZOL3YL)SULFANYL)BUTANAMIDE
N(4ACETYLPHENYL)2((5(4AMINOPHENYL)4METHYL4H124TRIAZOL3YL)SULFANYL)BUTANAMIDE
N(4acetylphenyl)2((5(4aminophenyl)4methyl4H124triazol3yl)thio)butanamide
STK013910
ZINC000004551774
ZINC000004551775
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