Vitas-M small molecule compound
(4E)-2-(1,3-benzothiazol-2-yl)-5-{[(4-chlorophenyl)sulfanyl]methyl}-4-({[3-(1H-imidazol-1-yl)propyl]amino}methylidene)-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STL447119
SMILES Clc1ccc(cc1)SCC1=NN(C(=O)/C/1=C/NCCCn1cncc1)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 C24H21ClN6OS2 MW 509.06 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H21ClN6OS2/c25-17-6-8-18(9-7-17)33-15-21-19(14-26-10-3-12-30-13-11-27-16-30)23(32)31(29-21)24-28-20-4-1-2-5-22(20)34-24/h1-2,4-9,11,13-14,16,26H,3,10,12,15H2/b19-14+InChIKey
JOZVLEVNKUWSOZ-XMHGGMMESA-NSynonyms
(4E)2(13benzothiazol2yl)5(((4chlorophenyl)sulfanyl)methyl)4(((3(1Himidazol1yl)propyl)amino)methylidene)24dihydro3Hpyrazol3one
(4E)2(13BENZOTHIAZOL2YL)5((4CHLOROPHENYL)SULFANYLMETHYL)4((3IMIDAZOL1YLPROPYLAMINO)METHYLIDENE)PYRAZOL3ONE
C1=CC=C2C(=C1)N=C(S2)N3C(=O)C(=CNCCCN4C=CN=C4)C(=N3)CSC5=CC=C(C=C5)Cl
Clc1ccc(cc1)SCC1=NN(C(=O)C1=CNCCCn1cncc1)c1nc2c(s1)cccc2
InChI=1SC24H21ClN6OS2c25176818(9717)33152119(142610312301311271630)23(32)31(2921)242820412522(20)3424h12491113141626H3101215H2b1914+
MFCD04421573
ZINC000100848983
ZINC100848983
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