Vitas-M small molecule compound
N-[(6-methoxy-1,3-benzothiazol-2-yl)carbamothioyl]-4-(morpholin-4-yl)-3-nitrobenzamide
Catalog ID
STK180401
SMILES COc1ccc2c(c1)sc(n2)NC(=S)NC(=O)c1ccc(c(c1)[N+](=O)[O-])N1CCOCC1
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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 C20H19N5O5S2 MW 473.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19N5O5S2/c1-29-13-3-4-14-17(11-13)32-20(21-14)23-19(31)22-18(26)12-2-5-15(16(10-12)25(27)28)24-6-8-30-9-7-24/h2-5,10-11H,6-9H2,1H3,(H2,21,22,23,26,31)InChIKey
QDWSVVAUJDSFKR-UHFFFAOYSA-NSynonyms
COC1=CC2=C(C=C1)N=C(S2)NC(=S)NC(=O)C3=CC(=C(C=C3)N4CCOCC4)(N+)(=O)(O)
COc1ccc2c(c1)sc(n2)NC(=S)NC(=O)c1ccc(c(c1)(N+)(=O)(O))N1CCOCC1
InChI=1SC20H19N5O5S2c12913341417(1113)3220(2114)2319(31)2218(26)122515(16(1012)25(27)28)2468309724h251011H69H21H3(H22122232631)
MFCD06628249
N((6METHOXY13BENZOTHIAZOL2YL)CARBAMOTHIOYL)4(MORPHOLIN4YL)3NITROBENZAMIDE
N((6METHOXY13BENZOTHIAZOL2YL)CARBAMOTHIOYL)4MORPHOLIN4YL3NITROBENZAMIDE
ZINC000009892787
ZINC09892787
ZINC9892787
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