Vitas-M small molecule compound
ethyl (7Z)-2-amino-7-{(2E)-[2-amino-3-(ethoxycarbonyl)-5,6-dihydro-1-benzothiophen-7(4H)-ylidene]hydrazinylidene}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK280184
SMILES CCOC(=O)c1c(N)sc2c1CCC/C/2=N\N=C/1\CCCc2c1sc(c2C(=O)OCC)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 C22H26N4O4S2 MW 474.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26N4O4S2/c1-3-29-21(27)15-11-7-5-9-13(17(11)31-19(15)23)25-26-14-10-6-8-12-16(22(28)30-4-2)20(24)32-18(12)14/h3-10,23-24H2,1-2H3/b25-13-,26-14+InChIKey
VYBKVKQDDNFCPJ-KGRJIBJCSA-NSynonyms
CCOC(=O)C1=C(SC2=C1CCCC2=NN=C3CCCC4=C3SC(=C4C(=O)OCC)N)N
CCOC(=O)c1c(N)sc2c1CCCC2=NN=C1CCCc2c1sc(c2C(=O)OCC)N
ethyl(7Z)2amino7((2E)(2amino3(ethoxycarbonyl)56dihydro1benzothiophen7(4H)ylidene)hydrazinylidene)4567tetrahydro1benzothiophene3carboxylate
ethyl(7Z)2amino7((E)(2amino3ethoxycarbonyl56dihydro4H1benzothiophen7ylidene)hydrazinylidene)56dihydro4H1benzothiophene3carboxylate
InChI=1SC22H26N4O4S2c132921(27)151175913(17(11)3119(15)23)25261410681216(22(28)3042)20(24)3218(12)14h3102324H212H3b25132614+
MFCD02905995
ZINC000013941956
ZINC13941956
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