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

Catalog ID
STL051645
SMILES COc1cc(NC(=O)c2ccccc2)c(cc1NC(=O)CSc1nnc(n1c1ccc(cc1)OC)c1ccccn1)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 C31H28N6O4S MW 580.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H28N6O4S/c1-20-17-26(27(41-3)18-25(20)34-30(39)21-9-5-4-6-10-21)33-28(38)19-42-31-36-35-29(24-11-7-8-16-32-24)37(31)22-12-14-23(40-2)15-13-22/h4-18H,19H2,1-3H3,(H,33,38)(H,34,39)
InChIKey
WMMWALHWFRXNAT-UHFFFAOYSA-N
Synonyms

CC1=CC(=C(C=C1NC(=O)C2=CC=CC=C2)OC)NC(=O)CSC3=NN=C(N3C4=CC=C(C=C4)OC)C5=CC=CC=N5
InChI=1SC31H28N6O4Sc1201726(27(413)1825(20)3430(39)2195461021)3328(38)194231363529(241178163224)37(31)22121423(402)151322h418H19H213H3(H3338)(H3439)
MFCD07205138
N(2METHOXY5METHYL4(PHENYLCARBONYLAMINO)PHENYL)2(4(4METHOXYPHENYL)5(2PYRIDYL)(124TRIAZOL3YLTHIO))ACETAMIDE
N(5methoxy4((((4(4methoxyphenyl)5(pyridin2yl)4H124triazol3yl)sulfanyl)acetyl)amino)2methylphenyl)benzamide
N(5methoxy4((2((4(4methoxyphenyl)5pyridin2yl124triazol3yl)sulfanyl)acetyl)amino)2methylphenyl)benzamide
N(5METHOXY4(2((4(4METHOXYPHENYL)5(PYRIDIN2YL)4H124TRIAZOL3YL)SULFANYL)ACETAMIDO)2METHYLPHENYL)BENZAMIDE
N(5methoxy4(2((4(4methoxyphenyl)5(pyridin2yl)4H124triazol3yl)thio)acetamido)2methylphenyl)benzamide
ZINC000097990092
ZINC97990092

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Available files

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