Vitas-M small molecule compound
2-(4-tert-butylphenoxy)-N-{[6-methyl-2-(4-methylphenyl)-2H-benzotriazol-5-yl]carbamothioyl}acetamide
Catalog ID
STK184566
SMILES O=C(NC(=S)Nc1cc2nn(nc2cc1C)c1ccc(cc1)C)COc1ccc(cc1)C(C)(C)C
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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 C27H29N5O2S MW 487.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29N5O2S/c1-17-6-10-20(11-7-17)32-30-23-14-18(2)22(15-24(23)31-32)28-26(35)29-25(33)16-34-21-12-8-19(9-13-21)27(3,4)5/h6-15H,16H2,1-5H3,(H2,28,29,33,35)InChIKey
PZYZFWCAECEDRL-UHFFFAOYSA-NSynonyms
2(4TERTBUTYLPHENOXY)N((6METHYL2(4METHYLPHENYL)2HBENZOTRIAZOL5YL)CARBAMOTHIOYL)ACETAMIDE
2(4TERTBUTYLPHENOXY)N((6METHYL2(4METHYLPHENYL)BENZOTRIAZOL5YL)CARBAMOTHIOYL)ACETAMIDE
2(4TERTBUTYLPHENOXY)N(6METHYL2PTOLYL2HBENZO(D)(123)TRIAZOL5YLCARBAMOTHIOYL)ACETAMIDE
CC1=CC=C(C=C1)N2N=C3C=C(C(=CC3=N2)NC(=S)NC(=O)COC4=CC=C(C=C4)C(C)(C)C)C
InChI=1SC27H29N5O2Sc11761020(11717)3230231418(2)22(1524(23)3132)2826(35)2925(33)16342112819(91321)27(34)5h615H16H215H3(H228293335)
MFCD02799417
ZINC000003772598
ZINC03772598
ZINC3772598
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