Vitas-M small molecule compound

2-{[5-(4-tert-butylphenyl)-4-(4-methylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N'-[(Z)-(2-methylphenyl)methylidene]acetohydrazide

Catalog ID
STK102885
SMILES O=C(CSc1nnc(n1c1ccc(cc1)C)c1ccc(cc1)C(C)(C)C)N/N=C\c1ccccc1C

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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 C29H31N5OS MW 497.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H31N5OS/c1-20-10-16-25(17-11-20)34-27(22-12-14-24(15-13-22)29(3,4)5)32-33-28(34)36-19-26(35)31-30-18-23-9-7-6-8-21(23)2/h6-18H,19H2,1-5H3,(H,31,35)/b30-18-
InChIKey
GMFCXZQUMYJKME-YKQZZPSBSA-N
Synonyms

(E)2((5(4(tertbutyl)phenyl)4(ptolyl)4H124triazol3yl)thio)N(2methylbenzylidene)acetohydrazide
2((5(4TERTBUTYLPHENYL)4(4METHYLPHENYL)124TRIAZOL3YL)SULFANYL)N((Z)(2METHYLPHENYL)METHYLIDENEAMINO)ACETAMIDE
2((5(4TERTBUTYLPHENYL)4(4METHYLPHENYL)4H124TRIAZOL3YL)SULFANYL)N((Z)(2METHYLPHENYL)METHYLIDENE)ACETOHYDRAZIDE
CC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NN=CC3=CC=CC=C3C)C4=CC=C(C=C4)C(C)(C)C
InChI=1SC29H31N5OSc120101625(171120)3427(22121424(151322)29(34)5)323328(34)361926(35)31301823976821(23)2h618H19H215H3(H3135)b3018
MFCD03219878
N((1Z)2(2METHYLPHENYL)1AZAVINYL)2(5(4(TERTBUTYL)PHENYL)4(4METHYLPHENYL)(124TRIAZOL3YLTHIO))ACETAMIDE
O=C(CSc1nnc(n1c1ccc(cc1)C)c1ccc(cc1)C(C)(C)C)NN=Cc1ccccc1C
ZINC000009762543
ZINC01822482
ZINC1822482

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Available files

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