Vitas-M small molecule compound

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

Catalog ID
STK237013
SMILES CCCCc1ccc(cc1)n1nc2c(n1)cc(c(c2)Cl)NC(=S)NC(=O)c1c(OC)cccc1OC

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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 C26H26ClN5O3S MW 524.04 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26ClN5O3S/c1-4-5-7-16-10-12-17(13-11-16)32-30-20-14-18(27)19(15-21(20)31-32)28-26(36)29-25(33)24-22(34-2)8-6-9-23(24)35-3/h6,8-15H,4-5,7H2,1-3H3,(H2,28,29,33,36)
InChIKey
LMYMNZKTKIGFSN-UHFFFAOYSA-N
Synonyms

CCCCC1=CC=C(C=C1)N2N=C3C=C(C(=CC3=N2)Cl)NC(=S)NC(=O)C4=C(C=CC=C4OC)OC
InChI=1SC26H26ClN5O3Sc145716101217(131116)3230201418(27)19(1521(20)3132)2826(36)2925(33)2422(342)86923(24)353h6815H457H213H3(H228293336)
MFCD08107287
N((2(4butylphenyl)6chloro2Hbenzotriazol5yl)carbamothioyl)26dimethoxybenzamide
N((2(4BUTYLPHENYL)6CHLOROBENZOTRIAZOL5YL)CARBAMOTHIOYL)26DIMETHOXYBENZAMIDE
ZINC000008921637
ZINC08921637
ZINC8921637

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Available files

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