Vitas-M small molecule compound
(4Z)-2-(1,3-benzothiazol-2-yl)-4-{1-[(3-chlorophenyl)amino]propylidene}-5-{[(4-chlorophenyl)sulfanyl]methyl}-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STL283969
SMILES CC/C(=C/1\C(=NN(C1=O)c1nc2c(s1)cccc2)CSc1ccc(cc1)Cl)/Nc1cccc(c1)Cl
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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 C26H20Cl2N4OS2 MW 539.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H20Cl2N4OS2/c1-2-20(29-18-7-5-6-17(28)14-18)24-22(15-34-19-12-10-16(27)11-13-19)31-32(25(24)33)26-30-21-8-3-4-9-23(21)35-26/h3-14,29H,2,15H2,1H3/b24-20-InChIKey
GVKLZPXPLCKHKC-GFMRDNFCSA-NSynonyms
(4Z)2(13benzothiazol2yl)4(1((3chlorophenyl)amino)propylidene)5(((4chlorophenyl)sulfanyl)methyl)24dihydro3Hpyrazol3one
(4Z)2(13benzothiazol2yl)4(1(3chloroanilino)propylidene)5((4chlorophenyl)sulfanylmethyl)pyrazol3one
CCC(=C1C(=NN(C1=O)c1nc2c(s1)cccc2)CSc1ccc(cc1)Cl)Nc1cccc(c1)Cl
CCC(=C1C(=NN(C1=O)C2=NC3=CC=CC=C3S2)CSC4=CC=C(C=C4)Cl)NC5=CC(=CC=C5)Cl
InChI=1SC26H20Cl2N4OS2c1220(291875617(28)1418)2422(153419121016(27)111319)3132(25(24)33)263021834923(21)3526h31429H215H21H3b2420
MFCD24852155
ZINC000097971285
ZINC97971285
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