Vitas-M small molecule compound

N-({6-methyl-2-[4-(propan-2-yl)phenyl]-2H-benzotriazol-5-yl}carbamothioyl)-2-phenoxyacetamide

Catalog ID
STK184568
SMILES CC(c1ccc(cc1)n1nc2c(n1)cc(c(c2)NC(=S)NC(=O)COc1ccccc1)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 C25H25N5O2S MW 459.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25N5O2S/c1-16(2)18-9-11-19(12-10-18)30-28-22-13-17(3)21(14-23(22)29-30)26-25(33)27-24(31)15-32-20-7-5-4-6-8-20/h4-14,16H,15H2,1-3H3,(H2,26,27,31,33)
InChIKey
RWSZBMSHKYUTAI-UHFFFAOYSA-N
Synonyms

CC1=CC2=NN(N=C2C=C1NC(=S)NC(=O)COC3=CC=CC=C3)C4=CC=C(C=C4)C(C)C
InChI=1SC25H25N5O2Sc116(2)1891119(121018)3028221317(3)21(1423(22)2930)2625(33)2724(31)1532207546820h41416H15H213H3(H226273133)
MFCD03307002
N((6METHYL2(4(1METHYLETHYL)PHENYL)2HBENZOTRIAZOL5YL)CARBAMOTHIOYL)2PHENOXYACETAMIDE
N((6METHYL2(4(PROPAN2YL)PHENYL)2HBENZOTRIAZOL5YL)CARBAMOTHIOYL)2PHENOXYACETAMIDE
N((6METHYL2(4PROPAN2YLPHENYL)BENZOTRIAZOL5YL)CARBAMOTHIOYL)2PHENOXYACETAMIDE
ZINC000009906624
ZINC09906624
ZINC9906624

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Available files

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