Vitas-M small molecule compound
N-{[2-(4-butylphenyl)-2H-benzotriazol-5-yl]carbamothioyl}-2-methoxy-3-methylbenzamide
Catalog ID
STK184671
SMILES CCCCc1ccc(cc1)n1nc2c(n1)cc(cc2)NC(=S)NC(=O)c1cccc(c1OC)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 C26H27N5O2S MW 473.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27N5O2S/c1-4-5-8-18-10-13-20(14-11-18)31-29-22-15-12-19(16-23(22)30-31)27-26(34)28-25(32)21-9-6-7-17(2)24(21)33-3/h6-7,9-16H,4-5,8H2,1-3H3,(H2,27,28,32,34)InChIKey
SISGMSNJGKQVNS-UHFFFAOYSA-NSynonyms
CCCCC1=CC=C(C=C1)N2N=C3C=CC(=CC3=N2)NC(=S)NC(=O)C4=C(C(=CC=C4)C)OC
InChI=1SC26H27N5O2Sc145818101320(141118)312922151219(1623(22)3031)2726(34)2825(32)2196717(2)24(21)333h67916H458H213H3(H227283234)
MFCD04096443
N((2(4BUTYLPHENYL)2HBENZOTRIAZOL5YL)CARBAMOTHIOYL)2METHOXY3METHYLBENZAMIDE
N((2(4BUTYLPHENYL)BENZOTRIAZOL5YL)CARBAMOTHIOYL)2METHOXY3METHYLBENZAMIDE
ZINC000009906669
ZINC09906669
ZINC9906669
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