Vitas-M small molecule compound
N-{[2-(4-butylphenyl)-6-chloro-2H-benzotriazol-5-yl]carbamothioyl}-4-(propan-2-yloxy)benzamide
Catalog ID
STK390924
SMILES CCCCc1ccc(cc1)n1nc2c(n1)cc(c(c2)Cl)NC(=S)NC(=O)c1ccc(cc1)OC(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 C27H28ClN5O2S MW 522.07 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28ClN5O2S/c1-4-5-6-18-7-11-20(12-8-18)33-31-24-15-22(28)23(16-25(24)32-33)29-27(36)30-26(34)19-9-13-21(14-10-19)35-17(2)3/h7-17H,4-6H2,1-3H3,(H2,29,30,34,36)InChIKey
BVMJMLAZEVCYJP-UHFFFAOYSA-NSynonyms
CCCCC1=CC=C(C=C1)N2N=C3C=C(C(=CC3=N2)Cl)NC(=S)NC(=O)C4=CC=C(C=C4)OC(C)C
InChI=1SC27H28ClN5O2Sc14561871120(12818)3331241522(28)23(1625(24)3233)2927(36)3026(34)1991321(141019)3517(2)3h717H46H213H3(H229303436)
MFCD03837021
N(((2(4BUTYLPHENYL)6CHLORO(2HYDROBENZOTRIAZOL5YL))AMINO)THIOXOMETHYL)(4(METHYLETHOXY)PHENYL)CARBOXAMIDE
N((2(4BUTYLPHENYL)6CHLORO2HBENZOTRIAZOL5YL)CARBAMOTHIOYL)4(1METHYLETHOXY)BENZAMIDE
N((2(4butylphenyl)6chloro2Hbenzotriazol5yl)carbamothioyl)4(propan2yloxy)benzamide
N((2(4BUTYLPHENYL)6CHLOROBENZOTRIAZOL5YL)CARBAMOTHIOYL)4PROPAN2YLOXYBENZAMIDE
ZINC000016193213
ZINC16193213
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