Vitas-M small molecule compound
2-chloro-N-{[2-(4-methoxyphenyl)-6-methyl-2H-benzotriazol-5-yl]carbamothioyl}benzamide
Catalog ID
STK061579
SMILES COc1ccc(cc1)n1nc2c(n1)cc(c(c2)C)NC(=S)NC(=O)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 C22H18ClN5O2S MW 451.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18ClN5O2S/c1-13-11-19-20(27-28(26-19)14-7-9-15(30-2)10-8-14)12-18(13)24-22(31)25-21(29)16-5-3-4-6-17(16)23/h3-12H,1-2H3,(H2,24,25,29,31)InChIKey
JUPGABBSSPWRTD-UHFFFAOYSA-NSynonyms
425679-25-02chloroN((2(4methoxyphenyl)6methyl2Hbenzo(d)(123)triazol5yl)carbamothioyl)benzamide
2CHLORON((2(4METHOXYPHENYL)6METHYL2HBENZOTRIAZOL5YL)CARBAMOTHIOYL)BENZAMIDE
2CHLORON((2(4METHOXYPHENYL)6METHYLBENZOTRIAZOL5YL)CARBAMOTHIOYL)BENZAMIDE
425679250
CC1=CC2=NN(N=C2C=C1NC(=S)NC(=O)C3=CC=CC=C3Cl)C4=CC=C(C=C4)OC
COc1ccc(cc1)n1nc2c(n1)cc(c(c2)C)NC(=S)NC(=O)c1ccccc1Cl
InChI=1SC22H18ClN5O2Sc113111920(2728(2619)147915(302)10814)1218(13)2422(31)2521(29)16534617(16)23h312H12H3(H224252931)
MFCD02627952
STK061579
ZINC000001169769
ZINC01169769
ZINC1169769
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