Vitas-M small molecule compound
{[5-methyl-4-({(E)-[4-(propan-2-yl)phenyl]methylidene}amino)-4H-1,2,4-triazol-3-yl]sulfanyl}acetic acid
Catalog ID
STL191405
SMILES OC(=O)CSc1nnc(n1/N=C/c1ccc(cc1)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 C15H18N4O2S MW 318.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H18N4O2S/c1-10(2)13-6-4-12(5-7-13)8-16-19-11(3)17-18-15(19)22-9-14(20)21/h4-8,10H,9H2,1-3H3,(H,20,21)/b16-8+InChIKey
LASQVZBCVULCNY-LZYBPNLTSA-NSynonyms
((5methyl4(((E)(4(propan2yl)phenyl)methylidene)amino)4H124triazol3yl)sulfanyl)aceticacid
2((5methyl4((E)(4propan2ylphenyl)methylideneamino)124triazol3yl)sulfanyl)aceticacid
CC1=NN=C(N1N=CC2=CC=C(C=C2)C(C)C)SCC(=O)O
InChI=1SC15H18N4O2Sc110(2)136412(5713)8161911(3)171815(19)22914(20)21h4810H9H213H3(H2021)b168+
MFCD22390316
OC(=O)CSc1nnc(n1N=Cc1ccc(cc1)C(C)C)C
ZINC000027525665
ZINC98027850
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