Vitas-M small molecule compound
ethyl 2-{[(2E)-2-cyano-3-(3-nitrophenyl)prop-2-enoyl]amino}-4-phenylthiophene-3-carboxylate
Catalog ID
STK739771
SMILES CCOC(=O)c1c(scc1c1ccccc1)NC(=O)/C(=C/c1cccc(c1)[N+](=O)[O-])/C#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 C23H17N3O5S MW 447.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H17N3O5S/c1-2-31-23(28)20-19(16-8-4-3-5-9-16)14-32-22(20)25-21(27)17(13-24)11-15-7-6-10-18(12-15)26(29)30/h3-12,14H,2H2,1H3,(H,25,27)/b17-11+InChIKey
VVRRXZQNLBLALW-GZTJUZNOSA-NSynonyms
327075-52-5(E)ethyl2(2cyano3(3nitrophenyl)acrylamido)4phenylthiophene3carboxylate
327075525
CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)C(=CC3=CC(=CC=C3)(N+)(=O)(O))C#N
CCOC(=O)c1c(scc1c1ccccc1)NC(=O)C(=Cc1cccc(c1)(N+)(=O)(O))C#N
ethyl2(((2E)2cyano3(3nitrophenyl)prop2enoyl)amino)4phenylthiophene3carboxylate
ETHYL2(((E)2CYANO3(3NITROPHENYL)PROP2ENOYL)AMINO)4PHENYLTHIOPHENE3CARBOXYLATE
ETHYL2((2E)2CYANO3(3NITROPHENYL)PROP2ENOYLAMINO)4PHENYLTHIOPHENE3CARBOXYLATE
InChI=1SC23H17N3O5Sc123123(28)2019(168435916)143222(20)2521(27)17(1324)1115761018(1215)26(29)30h31214H2H21H3(H2527)b1711+
MFCD01950584
ZINC000001856944
ZINC01856944
ZINC1856944
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