Vitas-M small molecule compound
methyl (4Z)-4-{[1-(1,3-benzothiazol-2-yl)hydrazinyl]carbonyl}-5-(morpholin-4-yl)-3-oxohex-4-enoate
Catalog ID
STK055526
SMILES COC(=O)CC(=O)/C(=C(/N1CCOCC1)\C)/C(=O)N(c1nc2c(s1)cccc2)N
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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 C19H22N4O5S MW 418.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H22N4O5S/c1-12(22-7-9-28-10-8-22)17(14(24)11-16(25)27-2)18(26)23(20)19-21-13-5-3-4-6-15(13)29-19/h3-6H,7-11,20H2,1-2H3/b17-12-InChIKey
WRBJVKAICJDSPO-ATVHPVEESA-NSynonyms
(E)methyl4(1(benzo(d)thiazol2yl)hydrazinecarbonyl)5morpholino3oxohex4enoate
CC(=C(C(=O)CC(=O)OC)C(=O)N(C1=NC2=CC=CC=C2S1)N)N3CCOCC3
COC(=O)CC(=O)C(=C(N1CCOCC1)C)C(=O)N(c1nc2c(s1)cccc2)N
InChI=1SC19H22N4O5Sc112(22792810822)17(14(24)1116(25)272)18(26)23(20)192113534615(13)2919h36H71120H212H3b1712
METHYL(4Z)4((1(13BENZOTHIAZOL2YL)HYDRAZINYL)CARBONYL)5(MORPHOLIN4YL)3OXOHEX4ENOATE
METHYL(4Z)4(NAMINONBENZOTHIAZOL2YLCARBAMOYL)5MORPHOLIN4YL3OXOHEX4ENOATE
METHYL(Z)4(AMINO(13BENZOTHIAZOL2YL)CARBAMOYL)5MORPHOLIN4YL3OXOHEX4ENOATE
MFCD03488755
STK055526
ZINC000013513402
ZINC13513402
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