Vitas-M small molecule compound

(4Z)-2-(1,3-benzothiazol-2-yl)-4-{1-[(2-methoxyethyl)amino]ethylidene}-5-propyl-2,4-dihydro-3H-pyrazol-3-one

Catalog ID
STK231944
SMILES COCCN/C(=C\1/C(=NN(C1=O)c1nc2c(s1)cccc2)CCC)/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 C18H22N4O2S MW 358.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22N4O2S/c1-4-7-14-16(12(2)19-10-11-24-3)17(23)22(21-14)18-20-13-8-5-6-9-15(13)25-18/h5-6,8-9,19H,4,7,10-11H2,1-3H3/b16-12-
InChIKey
DAPLYXAMHPZXFA-VBKFSLOCSA-N
Synonyms

(4Z)2(13benzothiazol2yl)4(1((2methoxyethyl)amino)ethylidene)5propyl24dihydro3Hpyrazol3one
(4Z)2(13BENZOTHIAZOL2YL)4(1(2METHOXYETHYLAMINO)ETHYLIDENE)5PROPYLPYRAZOL3ONE
1BENZOTHIAZOL2YL4(((2METHOXYETHYL)AMINO)ETHYLIDENE)3PROPYL12DIAZOLIN5ONE
CCCC1=NN(C(=O)C1=C(C)NCCOC)C2=NC3=CC=CC=C3S2
COCCNC(=C1C(=NN(C1=O)c1nc2c(s1)cccc2)CCC)C
InChI=1SC18H22N4O2Sc1471416(12(2)191011243)17(23)22(2114)182013856915(13)2518h568919H471011H213H3b1612
MFCD07792719
ZINC000100423300
ZINC100423300

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Available files

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