Vitas-M small molecule compound
3-[(E)-(4H-1,2,4-triazol-4-ylimino)methyl]phenyl 4-methylbenzenesulfonate
Catalog ID
STK040587
SMILES Cc1ccc(cc1)S(=O)(=O)Oc1cccc(c1)/C=N/n1cnnc1
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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 C16H14N4O3S MW 342.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H14N4O3S/c1-13-5-7-16(8-6-13)24(21,22)23-15-4-2-3-14(9-15)10-19-20-11-17-18-12-20/h2-12H,1H3/b19-10+InChIKey
YGXFSCZTXZEAOM-VXLYETTFSA-NSynonyms
(3((E)124TRIAZOL4YLIMINOMETHYL)PHENYL)4METHYLBENZENESULFONATE
3((1E)2(124TRIAZOL4YL)2AZAVINYL)PHENYL4METHYLBENZENESULFONATE
3((4H124TRIAZOL4YLIMINO)METHYL)PHENYL4METHYLBENZENESULFONATE
3((E)(4H124TRIAZOL4YLIMINO)METHYL)PHENYL4METHYLBENZENESULFONATE
CC1=CC=C(C=C1)S(=O)(=O)OC2=CC=CC(=C2)C=NN3C=NN=C3
Cc1ccc(cc1)S(=O)(=O)Oc1cccc(c1)C=Nn1cnnc1
InChI=1SC16H14N4O3Sc1135716(8613)24(2122)231542314(915)1019201117181220h212H1H3b1910+
MFCD02124023
STK040587
ZINC000002971189
ZINC33398355
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