Vitas-M small molecule compound

2-{[(2E)-3-(5-nitrofuran-2-yl)prop-2-enoyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

Catalog ID
STL171853
SMILES O=C(Nc1sc2c(c1C(=O)N)CCCC2)/C=C/c1ccc(o1)[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 C16H15N3O5S MW 361.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H15N3O5S/c17-15(21)14-10-3-1-2-4-11(10)25-16(14)18-12(20)7-5-9-6-8-13(24-9)19(22)23/h5-8H,1-4H2,(H2,17,21)(H,18,20)/b7-5+
InChIKey
WONGNDCFXIIJFL-FNORWQNLSA-N
Synonyms
514838-61-0
2(((2E)3(5nitrofuran2yl)prop2enoyl)amino)4567tetrahydro1benzothiophene3carboxamide
2(((E)3(5nitrofuran2yl)prop2enoyl)amino)4567tetrahydro1benzothiophene3carboxamide
514838610
C1CCC2=C(C1)C(=C(S2)NC(=O)C=CC3=CC=C(O3)(N+)(=O)(O))C(=O)N
InChI=1SC16H15N3O5Sc1715(21)1410312411(10)2516(14)1812(20)7596813(249)19(22)23h58H14H2(H21721)(H1820)b75+
MFCD03757651
O=C(Nc1sc2c(c1C(=O)N)CCCC2)C=Cc1ccc(o1)(N+)(=O)(O)
ZINC000002761038
ZINC02761038
ZINC2761038

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Available files

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