Vitas-M small molecule compound
N-(4-bromophenyl)-2-{[4-(2-phenylethyl)-5-(3,4,5-triethoxyphenyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Catalog ID
STK207982
SMILES CCOc1cc(cc(c1OCC)OCC)c1nnc(n1CCc1ccccc1)SCC(=O)Nc1ccc(cc1)Br
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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 C30H33BrN4O4S MW 625.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H33BrN4O4S/c1-4-37-25-18-22(19-26(38-5-2)28(25)39-6-3)29-33-34-30(35(29)17-16-21-10-8-7-9-11-21)40-20-27(36)32-24-14-12-23(31)13-15-24/h7-15,18-19H,4-6,16-17,20H2,1-3H3,(H,32,36)InChIKey
YMOJKJKDRATEMU-UHFFFAOYSA-NSynonyms
CCOC1=CC(=CC(=C1OCC)OCC)C2=NN=C(N2CCC3=CC=CC=C3)SCC(=O)NC4=CC=C(C=C4)Br
InChI=1SC30H33BrN4O4Sc1437251822(1926(3852)28(25)3963)29333430(35(29)171621108791121)402027(36)3224141223(31)131524h7151819H46161720H213H3(H3236)
MFCD03194971
N(4bromophenyl)2((4(2phenylethyl)5(345triethoxyphenyl)124triazol3yl)sulfanyl)acetamide
N(4bromophenyl)2((4(2phenylethyl)5(345triethoxyphenyl)4H124triazol3yl)sulfanyl)acetamide
N(4BROMOPHENYL)2((4PHENETHYL5(345TRIETHOXYPHENYL)124TRIAZOL3YL)SULFANYL)ACETAMIDE
N(4bromophenyl)2((4phenethyl5(345triethoxyphenyl)4H124triazol3yl)thio)acetamide
N(4BROMOPHENYL)2(4(2PHENYLETHYL)5(345TRIETHOXYPHENYL)(124TRIAZOL3YLTHIO))ACETAMIDE
ZINC000097948987
ZINC97948987
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