Vitas-M small molecule compound
methyl 4-{[({5-[1-(4-ethylphenoxy)ethyl]-4-methyl-4H-1,2,4-triazol-3-yl}sulfanyl)acetyl]amino}benzoate
Catalog ID
STK114719
SMILES COC(=O)c1ccc(cc1)NC(=O)CSc1nnc(n1C)C(Oc1ccc(cc1)CC)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 C23H26N4O4S MW 454.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H26N4O4S/c1-5-16-6-12-19(13-7-16)31-15(2)21-25-26-23(27(21)3)32-14-20(28)24-18-10-8-17(9-11-18)22(29)30-4/h6-13,15H,5,14H2,1-4H3,(H,24,28)InChIKey
WHQUABNBHDYMCO-UHFFFAOYSA-NSynonyms
CCC1=CC=C(C=C1)OC(C)C2=NN=C(N2C)SCC(=O)NC3=CC=C(C=C3)C(=O)OC
InChI=1SC23H26N4O4Sc151661219(13716)3115(2)21252623(27(21)3)321420(28)241810817(91118)22(29)304h61315H514H214H3(H2428)
METHYL4((((5((1R)1(4ETHYLPHENOXY)ETHYL)4METHYL4H124TRIAZOL3YL)SULFANYL)ACETYL)AMINO)BENZOATE
METHYL4((((5(1(4ETHYLPHENOXY)ETHYL)4METHYL4H124TRIAZOL3YL)SULFANYL)ACETYL)AMINO)BENZOATE
METHYL4((2((5(1(4ETHYLPHENOXY)ETHYL)4METHYL124TRIAZOL3YL)SULFANYL)ACETYL)AMINO)BENZOATE
MFCD04128147
ZINC000001142579
ZINC000002835764
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