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N-{5-methoxy-2-methyl-4-[({[4-(4-methylphenyl)-5-(pyrazin-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]phenyl}benzamide

Catalog ID
STL042097
SMILES COc1cc(NC(=O)c2ccccc2)c(cc1NC(=O)CSc1nnc(n1c1ccc(cc1)C)c1cnccn1)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 C30H27N7O3S MW 565.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H27N7O3S/c1-19-9-11-22(12-10-19)37-28(25-17-31-13-14-32-25)35-36-30(37)41-18-27(38)33-24-15-20(2)23(16-26(24)40-3)34-29(39)21-7-5-4-6-8-21/h4-17H,18H2,1-3H3,(H,33,38)(H,34,39)
InChIKey
GQDZJFPUAVVRCQ-UHFFFAOYSA-N
Synonyms

CC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NC3=C(C=C(C(=C3)C)NC(=O)C4=CC=CC=C4)OC)C5=NC=CN=C5
InChI=1SC30H27N7O3Sc11991122(121019)3728(25173113143225)353630(37)411827(38)33241520(2)23(1626(24)403)3429(39)217546821h417H18H213H3(H3338)(H3439)
MFCD07209556
N(2METHOXY5METHYL4(PHENYLCARBONYLAMINO)PHENYL)2(4(4METHYLPHENYL)5PYRAZIN2YL(124TRIAZOL3YLTHIO))ACETAMIDE
N(5methoxy2methyl4((((4(4methylphenyl)5(pyrazin2yl)4H124triazol3yl)sulfanyl)acetyl)amino)phenyl)benzamide
N(5methoxy2methyl4((2((4(4methylphenyl)5pyrazin2yl124triazol3yl)sulfanyl)acetyl)amino)phenyl)benzamide
N(5METHOXY2METHYL4(2((4(4METHYLPHENYL)5(PYRAZIN2YL)4H124TRIAZOL3YL)SULFANYL)ACETAMIDO)PHENYL)BENZAMIDE
N(5methoxy2methyl4(2((5(pyrazin2yl)4(ptolyl)4H124triazol3yl)thio)acetamido)phenyl)benzamide
ZINC000097990095
ZINC97990095

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Available files

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