Vitas-M small molecule compound

4-sulfamoyl-N-[(1E)-2-(4,4,5,5-tetramethyl-1,3-dioxolan-2-ylidene)ethylidene]anilinium

Catalog ID
STK078771
SMILES CC1(C)OC(=C/C=[NH+]/c2ccc(cc2)S(=O)(=O)N)OC1(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 C15H21N2O4S MW 325.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H20N2O4S/c1-14(2)15(3,4)21-13(20-14)9-10-17-11-5-7-12(8-6-11)22(16,18)19/h5-10H,1-4H3,(H2,16,18,19)/p+1/b17-10+
InChIKey
VTJTZWPDYDFVNN-LICLKQGHSA-O
Synonyms

(E)(4sulfamoylphenyl)(2(4455tetramethyl13dioxolan2ylidene)ethylidene)azanium
(Z)4sulfamoylN(2(4455tetramethyl13dioxolan2ylidene)ethylidene)benzenaminiumtetrafluoroborate
4sulfamoylN((1E)2(4455tetramethyl13dioxolan2ylidene)ethylidene)anilinium
CC1(C(OC(=CC=(NH+)C2=CC=C(C=C2)S(=O)(=O)N)O1)(C)C)C
CC1(C)OC(=CC=(NH+)c2ccc(cc2)S(=O)(=O)N)OC1(C)C
CC1(C)OC(=CC=(NH+)c2ccc(cc2)S(=O)(=O)N)OC1(C)CF(B)(F)(F)F
InChI=1SC15H20N2O4Sc114(2)15(34)2113(2014)91017115712(8611)22(1618)19h510H14H3(H2161819)p+1b1710+
MFCD00841133
STK078771
ZINC000013892702
ZINC000254632488

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Available files

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