Vitas-M small molecule compound
2-{[5-benzyl-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[4-bromo-2-(propan-2-yl)phenyl]acetamide
Catalog ID
STK129481
SMILES C=CCn1c(SCC(=O)Nc2ccc(cc2C(C)C)Br)nnc1Cc1ccccc1
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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 C23H25BrN4OS MW 485.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25BrN4OS/c1-4-12-28-21(13-17-8-6-5-7-9-17)26-27-23(28)30-15-22(29)25-20-11-10-18(24)14-19(20)16(2)3/h4-11,14,16H,1,12-13,15H2,2-3H3,(H,25,29)InChIKey
UTPNGAZIKCGYJU-UHFFFAOYSA-NSynonyms
2((5BENZYL4(PROP2EN1YL)4H124TRIAZOL3YL)SULFANYL)N(4BROMO2(PROPAN2YL)PHENYL)ACETAMIDE
2((5BENZYL4PROP2ENYL124TRIAZOL3YL)SULFANYL)N(4BROMO2PROPAN2YLPHENYL)ACETAMIDE
2(4ALLYL5BENZYL4H(124)TRIAZOL3YLSULFANYL)N(4BROMO2ISOPROPYLPHENYL)ACETAMIDE
CC(C)C1=C(C=CC(=C1)Br)NC(=O)CSC2=NN=C(N2CC=C)CC3=CC=CC=C3
InChI=1SC23H25BrN4OSc14122821(13178657917)262723(28)301522(29)2520111018(24)1419(20)16(2)3h4111416H1121315H223H3(H2529)
MFCD04388064
ZINC000002861724
ZINC02861724
ZINC2861724
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