Vitas-M small molecule compound

2-{[5-(4-tert-butylphenyl)-4-(4-methoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(naphthalen-1-yl)acetamide

Catalog ID
STK558422
SMILES COc1ccc(cc1)n1c(SCC(=O)Nc2cccc3c2cccc3)nnc1c1ccc(cc1)C(C)(C)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 C31H30N4O2S MW 522.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H30N4O2S/c1-31(2,3)23-14-12-22(13-15-23)29-33-34-30(35(29)24-16-18-25(37-4)19-17-24)38-20-28(36)32-27-11-7-9-21-8-5-6-10-26(21)27/h5-19H,20H2,1-4H3,(H,32,36)
InChIKey
NNRMNLTVZCKRMG-UHFFFAOYSA-N
Synonyms
586991-92-6
2((5(4(tertbutyl)phenyl)4(4methoxyphenyl)4H124triazol3yl)thio)N(naphthalen1yl)acetamide
2((5(4TERTBUTYLPHENYL)4(4METHOXYPHENYL)124TRIAZOL3YL)SULFANYL)NNAPHTHALEN1YLACETAMIDE
2((5(4tertbutylphenyl)4(4methoxyphenyl)4H124triazol3yl)sulfanyl)N(naphthalen1yl)acetamide
2(5(4(TERTBUTYL)PHENYL)4(4METHOXYPHENYL)(124TRIAZOL3YLTHIO))NNAPHTHYLACETAMIDE
586991926
CC(C)(C)C1=CC=C(C=C1)C2=NN=C(N2C3=CC=C(C=C3)OC)SCC(=O)NC4=CC=CC5=CC=CC=C54
InChI=1SC31H30N4O2Sc131(23)23141222(131523)29333430(35(29)24161825(374)191724)382028(36)32271179218561026(21)27h519H20H214H3(H3236)
MFCD03224015
ZINC000002395143
ZINC02395143
ZINC2395143

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Available files

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