Vitas-M small molecule compound
2-{[4-amino-5-(4-tert-butylphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(2-methoxy-5-methylphenyl)acetamide
Catalog ID
STL340074
SMILES COc1ccc(cc1NC(=O)CSc1nnc(n1N)c1ccc(cc1)C(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 C22H27N5O2S MW 425.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H27N5O2S/c1-14-6-11-18(29-5)17(12-14)24-19(28)13-30-21-26-25-20(27(21)23)15-7-9-16(10-8-15)22(2,3)4/h6-12H,13,23H2,1-5H3,(H,24,28)InChIKey
PXXXGALTNOVQMM-UHFFFAOYSA-NSynonyms
811465-67-52((4amino5(4(tertbutyl)phenyl)4H124triazol3yl)thio)N(2methoxy5methylphenyl)acetamide
2((4AMINO5(4TERTBUTYLPHENYL)124TRIAZOL3YL)SULFANYL)N(2METHOXY5METHYLPHENYL)ACETAMIDE
2((4amino5(4tertbutylphenyl)4H124triazol3yl)sulfanyl)N(2methoxy5methylphenyl)acetamide
2(4AMINO5(4(TERTBUTYL)PHENYL)(124TRIAZOL3YLTHIO))N(2METHOXY5METHYLPHENYL)ACETAMIDE
811465675
CC1=CC(=C(C=C1)OC)NC(=O)CSC2=NN=C(N2N)C3=CC=C(C=C3)C(C)(C)C
InChI=1SC22H27N5O2Sc11461118(295)17(1214)2419(28)133021262520(27(21)23)157916(10815)22(23)4h612H1323H215H3(H2428)
MFCD04016482
ZINC000002522430
ZINC02522430
ZINC2522430
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