Vitas-M small molecule compound
N-benzyl-N-(2-{[(2E)-2-(3,3-dimethylbutan-2-ylidene)hydrazinyl]carbonyl}phenyl)-4-methoxybenzenesulfonamide
Catalog ID
STL136912
SMILES COc1ccc(cc1)S(=O)(=O)N(c1ccccc1C(=O)N/N=C(/C(C)(C)C)\C)Cc1ccccc1
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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 C27H31N3O4S MW 493.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H31N3O4S/c1-20(27(2,3)4)28-29-26(31)24-13-9-10-14-25(24)30(19-21-11-7-6-8-12-21)35(32,33)23-17-15-22(34-5)16-18-23/h6-18H,19H2,1-5H3,(H,29,31)/b28-20+InChIKey
BJNWAQHRSNBOCI-VFCFBJKWSA-NSynonyms
2(BENZYL(4METHOXYPHENYL)SULFONYLAMINO)N((E)33DIMETHYLBUTAN2YLIDENEAMINO)BENZAMIDE
CC(=NNC(=O)C1=CC=CC=C1N(CC2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)OC)C(C)(C)C
COc1ccc(cc1)S(=O)(=O)N(c1ccccc1C(=O)NN=C(C(C)(C)C)C)Cc1ccccc1
InChI=1SC27H31N3O4Sc120(27(23)4)282926(31)24139101425(24)30(1921117681221)35(3233)23171522(345)161823h618H19H215H3(H2931)b2820+
MFCD03763029
NbenzylN(2(((2E)2(33dimethylbutan2ylidene)hydrazinyl)carbonyl)phenyl)4methoxybenzenesulfonamide
ZINC000014165735
ZINC1096123
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