Vitas-M small molecule compound
N-[4-({[(4-ethoxy-3-nitrophenyl)carbonyl]carbamothioyl}amino)phenyl]thiophene-2-carboxamide
Catalog ID
STK063438
SMILES CCOc1ccc(cc1[N+](=O)[O-])C(=O)NC(=S)Nc1ccc(cc1)NC(=O)c1cccs1
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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 C21H18N4O5S2 MW 470.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18N4O5S2/c1-2-30-17-10-5-13(12-16(17)25(28)29)19(26)24-21(31)23-15-8-6-14(7-9-15)22-20(27)18-4-3-11-32-18/h3-12H,2H2,1H3,(H,22,27)(H2,23,24,26,31)InChIKey
NDMHARLTSRRJFU-UHFFFAOYSA-NSynonyms
(4ETHOXY3NITROPHENYL)N(((4(2THIENYLCARBONYLAMINO)PHENYL)AMINO)THIOXOMETHYL)CARBOXAMIDE
CCOC1=C(C=C(C=C1)C(=O)NC(=S)NC2=CC=C(C=C2)NC(=O)C3=CC=CS3)(N+)(=O)(O)
CCOc1ccc(cc1(N+)(=O)(O))C(=O)NC(=S)Nc1ccc(cc1)NC(=O)c1cccs1
InChI=1SC21H18N4O5S2c12301710513(1216(17)25(28)29)19(26)2421(31)23158614(7915)2220(27)1843113218h312H2H21H3(H2227)(H223242631)
MFCD02820712
N(4((((4ETHOXY3NITROPHENYL)CARBONYL)CARBAMOTHIOYL)AMINO)PHENYL)THIOPHENE2CARBOXAMIDE
N(4((4ETHOXY3NITROBENZOYL)CARBAMOTHIOYLAMINO)PHENYL)THIOPHENE2CARBOXAMIDE
STK063438
ZINC000004089581
ZINC04089581
ZINC4089581
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