Vitas-M small molecule compound
dipropan-2-yl 3-methyl-5-{[(2E)-3-(3-nitrophenyl)prop-2-enoyl]amino}thiophene-2,4-dicarboxylate
Catalog ID
STK437597
SMILES CC(OC(=O)c1c(NC(=O)/C=C/c2cccc(c2)[N+](=O)[O-])sc(c1C)C(=O)OC(C)C)C
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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 C22H24N2O7S MW 460.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H24N2O7S/c1-12(2)30-21(26)18-14(5)19(22(27)31-13(3)4)32-20(18)23-17(25)10-9-15-7-6-8-16(11-15)24(28)29/h6-13H,1-5H3,(H,23,25)/b10-9+InChIKey
TVEPPZUIGWTCCO-MDZDMXLPSA-NSynonyms
CC(OC(=O)c1c(NC(=O)C=Cc2cccc(c2)(N+)(=O)(O))sc(c1C)C(=O)OC(C)C)C
CC1=C(SC(=C1C(=O)OC(C)C)NC(=O)C=CC2=CC(=CC=C2)(N+)(=O)(O))C(=O)OC(C)C
DIISOPROPYL5((3(3NITROPHENYL)ACRYLOYL)AMINO)3METHYL24THIOPHENEDICARBOXYLATE
dipropan2yl3methyl5(((2E)3(3nitrophenyl)prop2enoyl)amino)thiophene24dicarboxylate
DIPROPAN2YL3METHYL5(((E)3(3NITROPHENYL)PROP2ENOYL)AMINO)THIOPHENE24DICARBOXYLATE
InChI=1SC22H24N2O7Sc112(2)3021(26)1814(5)19(22(27)3113(3)4)3220(18)2317(25)1091576816(1115)24(28)29h613H15H3(H2325)b109+
METHYLETHYL5((2E)3(3NITROPHENYL)PROP2ENOYLAMINO)3METHYL4((METHYLETHYL)OXYCARBONYL)THIOPHENE2CARBOXYLATE
MFCD01352082
ZINC000002083664
ZINC02083664
ZINC2083664
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.