Vitas-M small molecule compound
N-{[2-(4-butylphenyl)-6-chloro-2H-benzotriazol-5-yl]carbamothioyl}-4-ethylbenzamide
Catalog ID
STK390923
SMILES CCCCc1ccc(cc1)n1nc2c(n1)cc(c(c2)NC(=S)NC(=O)c1ccc(cc1)CC)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 C26H26ClN5OS MW 492.04 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26ClN5OS/c1-3-5-6-18-9-13-20(14-10-18)32-30-23-15-21(27)22(16-24(23)31-32)28-26(34)29-25(33)19-11-7-17(4-2)8-12-19/h7-16H,3-6H2,1-2H3,(H2,28,29,33,34)InChIKey
NXQIZDIIADRCHD-UHFFFAOYSA-NSynonyms
CCCCC1=CC=C(C=C1)N2N=C3C=C(C(=CC3=N2)Cl)NC(=S)NC(=O)C4=CC=C(C=C4)CC
InChI=1SC26H26ClN5OSc13561891320(141018)3230231521(27)22(1624(23)3132)2826(34)2925(33)1911717(42)81219h716H36H212H3(H228293334)
MFCD03837018
N(((2(4BUTYLPHENYL)6CHLORO(2HYDROBENZOTRIAZOL5YL))AMINO)THIOXOMETHYL)(4ETHYLPHENYL)CARBOXAMIDE
N((2(4butylphenyl)6chloro2Hbenzotriazol5yl)carbamothioyl)4ethylbenzamide
N((2(4BUTYLPHENYL)6CHLOROBENZOTRIAZOL5YL)CARBAMOTHIOYL)4ETHYLBENZAMIDE
ZINC000016193205
ZINC16193205
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