Vitas-M small molecule compound
(4E)-2-(1,1-dioxidotetrahydrothiophen-3-yl)-4-{[(9-ethyl-9H-carbazol-3-yl)amino]methylidene}-5-methyl-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STL226697
SMILES CCn1c2ccc(cc2c2c1cccc2)N/C=C/1\C(=NN(C1=O)C1CCS(=O)(=O)C1)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 C23H24N4O3S MW 436.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H24N4O3S/c1-3-26-21-7-5-4-6-18(21)19-12-16(8-9-22(19)26)24-13-20-15(2)25-27(23(20)28)17-10-11-31(29,30)14-17/h4-9,12-13,17,24H,3,10-11,14H2,1-2H3/b20-13+InChIKey
RJVDGUIVUNJRCZ-DEDYPNTBSA-NSynonyms
(4E)2(11dioxidotetrahydrothiophen3yl)4(((9ethyl9Hcarbazol3yl)amino)methylidene)5methyl24dihydro3Hpyrazol3one
(4E)2(11dioxothiolan3yl)4(((9ethylcarbazol3yl)amino)methylidene)5methylpyrazol3one
(E)1(11dioxidotetrahydrothiophen3yl)4(((9ethyl9Hcarbazol3yl)amino)methylene)3methyl1Hpyrazol5(4H)one
CCN1C2=C(C=C(C=C2)NC=C3C(=NN(C3=O)C4CCS(=O)(=O)C4)C)C5=CC=CC=C51
CCn1c2ccc(cc2c2c1cccc2)NC=C1C(=NN(C1=O)C1CCS(=O)(=O)C1)C
InChI=1SC23H24N4O3Sc132621754618(21)191216(8922(19)26)24132015(2)2527(23(20)28)17101131(2930)1417h4912131724H3101114H212H3b2013+
MFCD09848941
ZINC000008993245
ZINC000008993246
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