Vitas-M small molecule compound
2-({4-amino-5-[3-(propan-2-yloxy)phenyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(4-ethylphenyl)acetamide
Catalog ID
STL342160
SMILES CCc1ccc(cc1)NC(=O)CSc1nnc(n1N)c1cccc(c1)OC(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 C21H25N5O2S MW 411.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25N5O2S/c1-4-15-8-10-17(11-9-15)23-19(27)13-29-21-25-24-20(26(21)22)16-6-5-7-18(12-16)28-14(2)3/h5-12,14H,4,13,22H2,1-3H3,(H,23,27)InChIKey
IKCHXHVHPIJWCM-UHFFFAOYSA-NSynonyms
586996-46-52((4amino5(3(propan2yloxy)phenyl)4H124triazol3yl)sulfanyl)N(4ethylphenyl)acetamide
2((4amino5(3isopropoxyphenyl)4H124triazol3yl)thio)N(4ethylphenyl)acetamide
2((4AMINO5(3PROPAN2YLOXYPHENYL)124TRIAZOL3YL)SULFANYL)N(4ETHYLPHENYL)ACETAMIDE
2(4AMINO5(3(METHYLETHOXY)PHENYL)(124TRIAZOL3YLTHIO))N(4ETHYLPHENYL)ACETAMIDE
586996465
CCC1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2N)C3=CC(=CC=C3)OC(C)C
InChI=1SC21H25N5O2Sc141581017(11915)2319(27)132921252420(26(21)22)1665718(1216)2814(2)3h51214H41322H213H3(H2327)
MFCD04033076
ZINC000002396581
ZINC02396581
ZINC2396581
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