Vitas-M small molecule compound
(4E)-2-(1,3-benzothiazol-2-yl)-4-[4-(dimethylamino)benzylidene]-5-propyl-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK022889
SMILES CCCC1=NN(C(=O)/C/1=C/c1ccc(cc1)N(C)C)c1nc2c(s1)cccc2
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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 C22H22N4OS MW 390.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N4OS/c1-4-7-18-17(14-15-10-12-16(13-11-15)25(2)3)21(27)26(24-18)22-23-19-8-5-6-9-20(19)28-22/h5-6,8-14H,4,7H2,1-3H3/b17-14+InChIKey
LQTLTCPSJZGSBM-SAPNQHFASA-NSynonyms
374093-63-7(4E)2(13benzothiazol2yl)4((4(dimethylamino)phenyl)methylidene)5propylpyrazol3one
(4E)2(13BENZOTHIAZOL2YL)4((4DIMETHYLAMINOPHENYL)METHYLIDENE)5PROPYLPYRAZOL3ONE
(4E)2(13BENZOTHIAZOL2YL)4(4(DIMETHYLAMINO)BENZYLIDENE)5PROPYL24DIHYDRO3HPYRAZOL3ONE
(E)1(benzo(d)thiazol2yl)4(4(dimethylamino)benzylidene)3propyl1Hpyrazol5(4H)one
1BENZOTHIAZOL2YL4((4(DIMETHYLAMINO)PHENYL)METHYLENE)3PROPYL12DIAZOLIN5ONE
374093637
CCCC1=NN(C(=O)C1=Cc1ccc(cc1)N(C)C)c1nc2c(s1)cccc2
CCCC1=NN(C(=O)C1=CC2=CC=C(C=C2)N(C)C)C3=NC4=CC=CC=C4S3
InChI=1SC22H22N4OSc1471817(1415101216(131115)25(2)3)21(27)26(2418)222319856920(19)2822h56814H47H213H3b1714+
MFCD01951318
STK022889
ZINC000100163510
ZINC100163510
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