Vitas-M small molecule compound
4-ethoxy-N-{[4-(morpholin-4-yl)phenyl]carbamothioyl}-3-nitrobenzamide
Catalog ID
STK163722
SMILES CCOc1ccc(cc1[N+](=O)[O-])C(=O)NC(=S)Nc1ccc(cc1)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 C20H22N4O5S MW 430.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H22N4O5S/c1-2-29-18-8-3-14(13-17(18)24(26)27)19(25)22-20(30)21-15-4-6-16(7-5-15)23-9-11-28-12-10-23/h3-8,13H,2,9-12H2,1H3,(H2,21,22,25,30)InChIKey
VHLOVYNKEAQTAJ-UHFFFAOYSA-NSynonyms
4ETHOXYN((4(MORPHOLIN4YL)PHENYL)CARBAMOTHIOYL)3NITROBENZAMIDE
4ETHOXYN((4MORPHOLIN4YLPHENYL)CARBAMOTHIOYL)3NITROBENZAMIDE
CCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)N3CCOCC3)(N+)(=O)(O)
CCOc1ccc(cc1(N+)(=O)(O))C(=O)NC(=S)Nc1ccc(cc1)N1CCOCC1
InChI=1SC20H22N4O5Sc1229188314(1317(18)24(26)27)19(25)2220(30)21154616(7515)2391128121023h3813H2912H21H3(H221222530)
MFCD02820625
ZINC000009846229
ZINC09846229
ZINC9846229
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