Vitas-M small molecule compound
2-(4-tert-butylphenyl)-N'-{(Z)-[3-({[3-cyano-6-(difluoromethyl)-4-methylpyridin-2-yl]sulfanyl}methyl)-4-methoxyphenyl]methylidene}cyclopropanecarbohydrazide
Catalog ID
STK451478
SMILES COc1ccc(cc1CSc1nc(cc(c1C#N)C)C(F)F)/C=N\NC(=O)C1CC1c1ccc(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 C31H32F2N4O2S MW 562.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H32F2N4O2S/c1-18-12-26(28(32)33)36-30(25(18)15-34)40-17-21-13-19(6-11-27(21)39-5)16-35-37-29(38)24-14-23(24)20-7-9-22(10-8-20)31(2,3)4/h6-13,16,23-24,28H,14,17H2,1-5H3,(H,37,38)/b35-16-InChIKey
AJAQKWMFKZGIDZ-NKHVPTTDSA-NSynonyms
2(4tertbutylphenyl)N((Z)(3(((3cyano6(difluoromethyl)4methylpyridin2yl)sulfanyl)methyl)4methoxyphenyl)methylidene)cyclopropanecarbohydrazide
2(4TERTBUTYLPHENYL)N((Z)(3((3CYANO6(DIFLUOROMETHYL)4METHYLPYRIDIN2YL)SULFANYLMETHYL)4METHOXYPHENYL)METHYLIDENEAMINO)CYCLOPROPANE1CARBOXAMIDE
2(4TERTBUTYLPHENYL)N(3(((3CYANO6(DIFLUOROMETHYL)4METHYL2PYRIDINYL)SULFANYL)METHYL)4METHOXYBENZYLIDENE)CYCLOPROPANECARBOHYDRAZIDE
CC1=CC(=NC(=C1C#N)SCC2=C(C=CC(=C2)C=NNC(=O)C3CC3C4=CC=C(C=C4)C(C)(C)C)OC)C(F)F
COc1ccc(cc1CSc1nc(cc(c1C#N)C)C(F)F)C=NNC(=O)C1CC1c1ccc(cc1)C(C)(C)C
InChI=1SC31H32F2N4O2Sc1181226(28(32)33)3630(25(18)1534)4017211319(61127(21)395)16353729(38)241423(24)207922(10820)31(23)4h61316232428H1417H215H3(H3738)b3516
MFCD02606415
N((1Z)2(3((6(DIFLUOROMETHYL)3CYANO4METHYL(2PYRIDYLTHIO))METHYL)4METHOXYPHENYL)1AZAVINYL)(2(4(TERTBUTYL)PHENYL)CYCLOPROPYL)CARBOXAMIDE
ZINC000097944462
ZINC000097944465
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