Vitas-M small molecule compound
(4Z)-2-(4-chlorophenyl)-4-[(1Z)-1-(3-ethyl-5-methoxy-1,3-benzothiazol-2(3H)-ylidene)butan-2-ylidene]-5-methyl-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK378079
SMILES CC/C(=C/1\C(=NN(C1=O)c1ccc(cc1)Cl)C)/C=c/1\sc2c(n1CC)cc(cc2)OC
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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 C24H24ClN3O2S MW 453.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H24ClN3O2S/c1-5-16(13-22-27(6-2)20-14-19(30-4)11-12-21(20)31-22)23-15(3)26-28(24(23)29)18-9-7-17(25)8-10-18/h7-14H,5-6H2,1-4H3/b22-13-,23-16-InChIKey
NIGZPTWLFGMEJW-LROCXXJGSA-NSynonyms
(4Z)2(4chlorophenyl)4((1Z)1(3ethyl5methoxy13benzothiazol2(3H)ylidene)butan2ylidene)5methyl24dihydro3Hpyrazol3one
(4Z)2(4CHLOROPHENYL)4((1Z)1(3ETHYL5METHOXY13BENZOTHIAZOL2YLIDENE)BUTAN2YLIDENE)5METHYLPYRAZOL3ONE
CCC(=C1C(=NN(C1=O)c1ccc(cc1)Cl)C)C=c1sc2c(n1CC)cc(cc2)OC
CCC(=C1C(=NN(C1=O)C2=CC=C(C=C2)Cl)C)C=C3N(C4=C(S3)C=CC(=C4)OC)CC
InChI=1SC24H24ClN3O2Sc1516(132227(62)201419(304)111221(20)3122)2315(3)2628(24(23)29)189717(25)81018h714H56H214H3b22132316
MFCD01823501
ZINC000004048112
ZINC04048112
ZINC4048112
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