Vitas-M small molecule compound
3-[(4-methylbenzyl)sulfanyl]-5-(2,4,5,6-tetrahydrocyclopenta[c]pyrazol-3-yl)-4H-1,2,4-triazol-4-amine
Catalog ID
STL058015
SMILES Cc1ccc(cc1)CSc1nnc(n1N)c1[nH]nc2c1CCC2
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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 C16H18N6S MW 326.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18N6S/c1-10-5-7-11(8-6-10)9-23-16-21-20-15(22(16)17)14-12-3-2-4-13(12)18-19-14/h5-8H,2-4,9,17H2,1H3,(H,18,19)InChIKey
UGGKAHPFSPNPLH-UHFFFAOYSA-NSynonyms
900877-07-83((4methylbenzyl)sulfanyl)5(2456tetrahydrocyclopenta(c)pyrazol3yl)4H124triazol4amine
3((4methylbenzyl)thio)5(1456tetrahydrocyclopenta(c)pyrazol3yl)4H124triazol4amine
3((4methylphenyl)methylsulfanyl)5(1456tetrahydrocyclopenta(c)pyrazol3yl)124triazol4amine
5((4METHYLPHENYL)METHYLTHIO)3(456TRIHYDROCYCLOPENTA(21D)PYRAZOL3YL)124TRIAZOLE4YLAMINE
900877078
CC1=CC=C(C=C1)CSC2=NN=C(N2N)C3=NNC4=C3CCC4
Cc1ccc(cc1)CSc1nnc(n1N)c1(nH)nc2c1CCC2
Cc1ccc(cc1)CSc1nnc(n1N)c1n(nH)c2c1CCC2
InChI=1SC16H18N6Sc1105711(8610)92316212015(22(16)17)141232413(12)181914h58H24917H21H3(H1819)
MFCD07206193
ZINC000009089239
ZINC09089239
ZINC9089239
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