Vitas-M small molecule compound

N-{[2-(4-butylphenyl)-6-methyl-2H-benzotriazol-5-yl]carbamothioyl}-2,4-dichlorobenzamide

Catalog ID
STK237222
SMILES CCCCc1ccc(cc1)n1nc2c(n1)cc(c(c2)C)NC(=S)NC(=O)c1ccc(cc1Cl)Cl

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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 C25H23Cl2N5OS MW 512.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23Cl2N5OS/c1-3-4-5-16-6-9-18(10-7-16)32-30-22-12-15(2)21(14-23(22)31-32)28-25(34)29-24(33)19-11-8-17(26)13-20(19)27/h6-14H,3-5H2,1-2H3,(H2,28,29,33,34)
InChIKey
FURDMRSOQCCJQS-UHFFFAOYSA-N
Synonyms

CCCCC1=CC=C(C=C1)N2N=C3C=C(C(=CC3=N2)NC(=S)NC(=O)C4=C(C=C(C=C4)Cl)Cl)C
InChI=1SC25H23Cl2N5OSc1345166918(10716)3230221215(2)21(1423(22)3132)2825(34)2924(33)1911817(26)1320(19)27h614H35H212H3(H228293334)
MFCD03786045
N((2(4butylphenyl)6methyl2Hbenzotriazol5yl)carbamothioyl)24dichlorobenzamide
N((2(4BUTYLPHENYL)6METHYLBENZOTRIAZOL5YL)CARBAMOTHIOYL)24DICHLOROBENZAMIDE
N(2(4BUTYLPHENYL)6METHYL2H123BENZOTRIAZOL5YL)N(24DICHLOROBENZOYL)THIOUREA
ZINC000008437801
ZINC08437801
ZINC8437801

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Available files

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