Vitas-M small molecule compound
N-(2-tert-butylphenyl)-2-{[5-(2-chlorophenyl)-4-(4-ethoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Catalog ID
STL048893
SMILES CCOc1ccc(cc1)n1c(SCC(=O)Nc2ccccc2C(C)(C)C)nnc1c1ccccc1Cl
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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 C28H29ClN4O2S MW 521.08 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H29ClN4O2S/c1-5-35-20-16-14-19(15-17-20)33-26(21-10-6-8-12-23(21)29)31-32-27(33)36-18-25(34)30-24-13-9-7-11-22(24)28(2,3)4/h6-17H,5,18H2,1-4H3,(H,30,34)InChIKey
CALCTZIEEAXKDX-UHFFFAOYSA-NSynonyms
848928-41-6848928416
CCOC1=CC=C(C=C1)N2C(=NN=C2SCC(=O)NC3=CC=CC=C3C(C)(C)C)C4=CC=CC=C4Cl
InChI=1SC28H29ClN4O2Sc153520161419(151720)3326(2110681223(21)29)313227(33)361825(34)302413971122(24)28(23)4h617H518H214H3(H3034)
MFCD04733076
N(2(tertbutyl)phenyl)2((5(2chlorophenyl)4(4ethoxyphenyl)4H124triazol3yl)thio)acetamide
N(2(TERTBUTYL)PHENYL)2(5(2CHLOROPHENYL)4(4ETHOXYPHENYL)(124TRIAZOL3YLTHIO))ACETAMIDE
N(2TERTBUTYLPHENYL)2((5(2CHLOROPHENYL)4(4ETHOXYPHENYL)124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(2tertbutylphenyl)2((5(2chlorophenyl)4(4ethoxyphenyl)4H124triazol3yl)sulfanyl)acetamide
ZINC000002444095
ZINC02444095
ZINC2444095
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