Vitas-M small molecule compound
N-{[2-(4-butylphenyl)-6-chloro-2H-benzotriazol-5-yl]carbamothioyl}-3,4-dimethylbenzamide
Catalog ID
STK236556
SMILES CCCCc1ccc(cc1)n1nc2c(n1)cc(c(c2)Cl)NC(=S)NC(=O)c1ccc(c(c1)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 C26H26ClN5OS MW 492.04 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26ClN5OS/c1-4-5-6-18-8-11-20(12-9-18)32-30-23-14-21(27)22(15-24(23)31-32)28-26(34)29-25(33)19-10-7-16(2)17(3)13-19/h7-15H,4-6H2,1-3H3,(H2,28,29,33,34)InChIKey
QPAKZLXNYPUQRF-UHFFFAOYSA-NSynonyms
(34DIMETHYLPHENYL)N(((2(4BUTYLPHENYL)6CHLORO(2HYDROBENZOTRIAZOL5YL))AMINO)THIOXOMETHYL)CARBOXAMIDE
CCCCC1=CC=C(C=C1)N2N=C3C=C(C(=CC3=N2)Cl)NC(=S)NC(=O)C4=CC(=C(C=C4)C)C
InChI=1SC26H26ClN5OSc14561881120(12918)3230231421(27)22(1524(23)3132)2826(34)2925(33)1910716(2)17(3)1319h715H46H213H3(H228293334)
MFCD04041944
N((2(4butylphenyl)6chloro2Hbenzotriazol5yl)carbamothioyl)34dimethylbenzamide
N((2(4BUTYLPHENYL)6CHLOROBENZOTRIAZOL5YL)CARBAMOTHIOYL)34DIMETHYLBENZAMIDE
ZINC000009190247
ZINC09190247
ZINC9190247
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