Vitas-M small molecule compound
propan-2-yl 2-{[({(4E)-1-(2-methylpropyl)-4-[(5-methylthiophen-2-yl)methylidene]-5-oxo-4,5-dihydro-1H-imidazol-2-yl}sulfanyl)acetyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK305275
SMILES Cc1ccc(s1)/C=C\1/N=C(N(C1=O)CC(C)C)SCC(=O)Nc1sc2c(c1C(=O)OC(C)C)CCCC2
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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 C27H33N3O4S3 MW 559.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H33N3O4S3/c1-15(2)13-30-25(32)20(12-18-11-10-17(5)36-18)28-27(30)35-14-22(31)29-24-23(26(33)34-16(3)4)19-8-6-7-9-21(19)37-24/h10-12,15-16H,6-9,13-14H2,1-5H3,(H,29,31)/b20-12+InChIKey
QMAITTZQIUNVJF-UDWIEESQSA-NSynonyms
676485-10-2676485102
CC1=CC=C(S1)C=C2C(=O)N(C(=N2)SCC(=O)NC3=C(C4=C(S3)CCCC4)C(=O)OC(C)C)CC(C)C
Cc1ccc(s1)C=C1N=C(N(C1=O)CC(C)C)SCC(=O)Nc1sc2c(c1C(=O)OC(C)C)CCCC2
InChI=1SC27H33N3O4S3c115(2)133025(32)20(1218111017(5)3618)2827(30)351422(31)292423(26(33)3416(3)4)19867921(19)3724h10121516H691314H215H3(H2931)b2012+
MFCD04050318
propan2yl2(((((4E)1(2methylpropyl)4((5methylthiophen2yl)methylidene)5oxo45dihydro1Himidazol2yl)sulfanyl)acetyl)amino)4567tetrahydro1benzothiophene3carboxylate
propan2yl2((2((4E)1(2methylpropyl)4((5methylthiophen2yl)methylidene)5oxoimidazol2yl)sulfanylacetyl)amino)4567tetrahydro1benzothiophene3carboxylate
ZINC000002785730
ZINC2785730
Check stock
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Check stock on Vitas-MAvailable files
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