Vitas-M small molecule compound

N-{[2-(4-ethoxyphenyl)-2H-benzotriazol-5-yl]carbamothioyl}hexanamide

Catalog ID
STK054942
SMILES CCCCCC(=O)NC(=S)Nc1ccc2c(c1)nn(n2)c1ccc(cc1)OCC

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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 C21H25N5O2S MW 411.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25N5O2S/c1-3-5-6-7-20(27)23-21(29)22-15-8-13-18-19(14-15)25-26(24-18)16-9-11-17(12-10-16)28-4-2/h8-14H,3-7H2,1-2H3,(H2,22,23,27,29)
InChIKey
WWEXWSQCDZASEG-UHFFFAOYSA-N
Synonyms
490015-87-7
490015877
CCCCCC(=O)NC(=S)NC1=CC2=NN(N=C2C=C1)C3=CC=C(C=C3)OCC
CCCCCC(=O)NC(=S)Nc1ccc2c(c1)nn(n2)c1ccc(cc1)OCC
InChI=1SC21H25N5O2Sc1356720(27)2321(29)22158131819(1415)2526(2418)1691117(121016)2842h814H37H212H3(H222232729)
MFCD02630810
N((2(4ethoxyphenyl)2Hbenzo(d)(123)triazol5yl)carbamothioyl)hexanamide
N((2(4ETHOXYPHENYL)2HBENZOTRIAZOL5YL)CARBAMOTHIOYL)HEXANAMIDE
N((2(4ETHOXYPHENYL)BENZOTRIAZOL5YL)CARBAMOTHIOYL)HEXANAMIDE
N(2(4ETHOXYPHENYL)2H123BENZOTRIAZOL5YL)NHEXANOYLTHIOUREA
STK054942
ZINC000002052148
ZINC02052148
ZINC2052148

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Available files

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