Vitas-M small molecule compound
2-[(5-{[(4-ethoxyphenyl)amino]methyl}-4-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N'-(2-methylcyclohexylidene)propanehydrazide
Catalog ID
STL174599
SMILES CCOc1ccc(cc1)NCc1nnc(n1c1ccccc1)SC(C(=O)N/N=C/1\CCCCC1C)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 C27H34N6O2S MW 506.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H34N6O2S/c1-4-35-23-16-14-21(15-17-23)28-18-25-30-32-27(33(25)22-11-6-5-7-12-22)36-20(3)26(34)31-29-24-13-9-8-10-19(24)2/h5-7,11-12,14-17,19-20,28H,4,8-10,13,18H2,1-3H3,(H,31,34)InChIKey
ULZCYFSRIHRZKQ-UHFFFAOYSA-NSynonyms
438615-77-12((5(((4ethoxyphenyl)amino)methyl)4phenyl4H124triazol3yl)sulfanyl)N(2methylcyclohexylidene)propanehydrazide
2((5((4ETHOXYANILINO)METHYL)4PHENYL124TRIAZOL3YL)SULFANYL)N((2METHYLCYCLOHEXYLIDENE)AMINO)PROPANAMIDE
438615771
CCOC1=CC=C(C=C1)NCC2=NN=C(N2C3=CC=CC=C3)SC(C)C(=O)NN=C4CCCCC4C
CCOc1ccc(cc1)NCc1nnc(n1c1ccccc1)SC(C(=O)NN=C1CCCCC1C)C
InChI=1SC27H34N6O2Sc143523161421(151723)281825303227(33(25)22116571222)3620(3)26(34)31292413981019(24)2h5711121417192028H48101318H213H3(H3134)
MFCD04047954
ZINC000013882016
ZINC000245240862
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