Vitas-M small molecule compound

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

Catalog ID
STL347374
SMILES COc1cccc(c1)NC(=O)CSc1nnc(n1c1ccc(cc1)C)c1ccc(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 C28H30N4O2S MW 486.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H30N4O2S/c1-19-9-15-23(16-10-19)32-26(20-11-13-21(14-12-20)28(2,3)4)30-31-27(32)35-18-25(33)29-22-7-6-8-24(17-22)34-5/h6-17H,18H2,1-5H3,(H,29,33)
InChIKey
WNJVUDDCKTXNNC-UHFFFAOYSA-N
Synonyms
849033-79-0
2((5(4(tertbutyl)phenyl)4(ptolyl)4H124triazol3yl)thio)N(3methoxyphenyl)acetamide
2((5(4TERTBUTYLPHENYL)4(4METHYLPHENYL)124TRIAZOL3YL)SULFANYL)N(3METHOXYPHENYL)ACETAMIDE
2((5(4tertbutylphenyl)4(4methylphenyl)4H124triazol3yl)sulfanyl)N(3methoxyphenyl)acetamide
2(5(4(TERTBUTYL)PHENYL)4(4METHYLPHENYL)(124TRIAZOL3YLTHIO))N(3METHOXYPHENYL)ACETAMIDE
849033790
CC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NC3=CC(=CC=C3)OC)C4=CC=C(C=C4)C(C)(C)C
InChI=1SC28H30N4O2Sc11991523(161019)3226(20111321(141220)28(23)4)303127(32)351825(33)292276824(1722)345h617H18H215H3(H2933)
MFCD05682180
ZINC000009307125
ZINC09307125
ZINC9307125

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Available files

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