Vitas-M small molecule compound
N-{[2-(4-butylphenyl)-6-chloro-2H-benzotriazol-5-yl]carbamothioyl}butanamide
Catalog ID
STK390929
SMILES CCCCc1ccc(cc1)n1nc2c(n1)cc(c(c2)NC(=S)NC(=O)CCC)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 C21H24ClN5OS MW 429.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24ClN5OS/c1-3-5-7-14-8-10-15(11-9-14)27-25-18-12-16(22)17(13-19(18)26-27)23-21(29)24-20(28)6-4-2/h8-13H,3-7H2,1-2H3,(H2,23,24,28,29)InChIKey
ILDULJYCBRGTRG-UHFFFAOYSA-NSynonyms
CCCCC1=CC=C(C=C1)N2N=C3C=C(C(=CC3=N2)Cl)NC(=S)NC(=O)CCC
InChI=1SC21H24ClN5OSc13571481015(11914)2725181216(22)17(1319(18)2627)2321(29)2420(28)642h813H37H212H3(H223242829)
MFCD03837014
N(((2(4BUTYLPHENYL)6CHLORO(2HYDROBENZOTRIAZOL5YL))AMINO)THIOXOMETHYL)BUTANAMIDE
N((2(4butylphenyl)6chloro2Hbenzotriazol5yl)carbamothioyl)butanamide
N((2(4BUTYLPHENYL)6CHLOROBENZOTRIAZOL5YL)CARBAMOTHIOYL)BUTANAMIDE
ZINC000016193196
ZINC16193196
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