Vitas-M small molecule compound
(4Z)-2-(1,3-benzothiazol-2-yl)-4-(1-{[3-(morpholin-4-yl)propyl]amino}ethylidene)-5-propyl-2,4-dihydro-3H-pyrazol-3-one
Catalog ID
STK261981
SMILES CCCC1=NN(C(=O)/C/1=C(\NCCCN1CCOCC1)/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 C22H29N5O2S MW 427.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H29N5O2S/c1-3-7-18-20(16(2)23-10-6-11-26-12-14-29-15-13-26)21(28)27(25-18)22-24-17-8-4-5-9-19(17)30-22/h4-5,8-9,23H,3,6-7,10-15H2,1-2H3/b20-16-InChIKey
CFFUPPYCEMIPLI-SILNSSARSA-NSynonyms
(4Z)2(13benzothiazol2yl)4(1((3(morpholin4yl)propyl)amino)ethylidene)5propyl24dihydro3Hpyrazol3one
(4Z)2(13benzothiazol2yl)4(1(3morpholin4ylpropylamino)ethylidene)5propylpyrazol3one
(Z)1(benzo(d)thiazol2yl)4(1((3morpholinopropyl)amino)ethylidene)3propyl1Hpyrazol5(4H)one
1BENZOTHIAZOL2YL4(((3MORPHOLIN4YLPROPYL)AMINO)ETHYLIDENE)3PROPYL12DIAZOLIN5ONE
CCCC1=NN(C(=O)C1=C(C)NCCCN2CCOCC2)C3=NC4=CC=CC=C4S3
CCCC1=NN(C(=O)C1=C(NCCCN1CCOCC1)C)c1nc2c(s1)cccc2
InChI=1SC22H29N5O2Sc1371820(16(2)231061126121429151326)21(28)27(2518)222417845919(17)3022h458923H3671015H212H3b2016
MFCD08548246
ZINC000100423245
ZINC100423245
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