Vitas-M small molecule compound
N-(6-{[(2E)-3-(3-nitrophenyl)prop-2-enoyl]amino}-1,3-benzothiazol-2-yl)butanamide
Catalog ID
STK498351
SMILES CCCC(=O)Nc1nc2c(s1)cc(cc2)NC(=O)/C=C/c1cccc(c1)[N+](=O)[O-]
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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 C20H18N4O4S MW 410.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18N4O4S/c1-2-4-18(25)23-20-22-16-9-8-14(12-17(16)29-20)21-19(26)10-7-13-5-3-6-15(11-13)24(27)28/h3,5-12H,2,4H2,1H3,(H,21,26)(H,22,23,25)/b10-7+InChIKey
SQAXMZVGVPDWFU-JXMROGBWSA-NSynonyms
CCCC(=O)NC1=NC2=C(S1)C=C(C=C2)NC(=O)C=CC3=CC(=CC=C3)(N+)(=O)(O)
CCCC(=O)Nc1nc2c(s1)cc(cc2)NC(=O)C=Cc1cccc(c1)(N+)(=O)(O)
InChI=1SC20H18N4O4Sc12418(25)232022169814(1217(16)2920)2119(26)1071353615(1113)24(27)28h3512H24H21H3(H2126)(H222325)b107+
MFCD09589091
N(6(((2E)3(3nitrophenyl)prop2enoyl)amino)13benzothiazol2yl)butanamide
N(6(((E)3(3nitrophenyl)prop2enoyl)amino)13benzothiazol2yl)butanamide
ZINC000017088483
ZINC17088483
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