Vitas-M small molecule compound
N-{[2-(4-butylphenyl)-6-chloro-2H-benzotriazol-5-yl]carbamothioyl}-5-(3,5-dichlorophenyl)furan-2-carboxamide
Catalog ID
STK236985
SMILES CCCCc1ccc(cc1)n1nc2c(n1)cc(c(c2)Cl)NC(=S)NC(=O)c1ccc(o1)c1cc(Cl)cc(c1)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 C28H22Cl3N5O2S MW 598.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H22Cl3N5O2S/c1-2-3-4-16-5-7-20(8-6-16)36-34-23-14-21(31)22(15-24(23)35-36)32-28(39)33-27(37)26-10-9-25(38-26)17-11-18(29)13-19(30)12-17/h5-15H,2-4H2,1H3,(H2,32,33,37,39)InChIKey
LWRIKYJEGHJPMQ-UHFFFAOYSA-NSynonyms
CCCCC1=CC=C(C=C1)N2N=C3C=C(C(=CC3=N2)Cl)NC(=S)NC(=O)C4=CC=C(O4)C5=CC(=CC(=C5)Cl)Cl
InChI=1SC28H22Cl3N5O2Sc1234165720(8616)3634231421(31)22(1524(23)3536)3228(39)3327(37)2610925(3826)171118(29)1319(30)1217h515H24H21H3(H232333739)
MFCD04073410
N((2(4butylphenyl)6chloro2Hbenzotriazol5yl)carbamothioyl)5(35dichlorophenyl)furan2carboxamide
N((2(4BUTYLPHENYL)6CHLOROBENZOTRIAZOL5YL)CARBAMOTHIOYL)5(35DICHLOROPHENYL)FURAN2CARBOXAMIDE
ZINC000001839102
ZINC1839102
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