Vitas-M small molecule compound

ethyl 5-methyl-2-({[4-(morpholin-4-ylcarbonyl)phenyl]carbamothioyl}amino)-4-phenylthiophene-3-carboxylate

Catalog ID
STK455899
SMILES CCOC(=O)c1c(NC(=S)Nc2ccc(cc2)C(=O)N2CCOCC2)sc(c1c1ccccc1)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 C26H27N3O4S2 MW 509.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H27N3O4S2/c1-3-33-25(31)22-21(18-7-5-4-6-8-18)17(2)35-23(22)28-26(34)27-20-11-9-19(10-12-20)24(30)29-13-15-32-16-14-29/h4-12H,3,13-16H2,1-2H3,(H2,27,28,34)
InChIKey
WIYQNIRMLULIGA-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=C(SC(=C1C2=CC=CC=C2)C)NC(=S)NC3=CC=C(C=C3)C(=O)N4CCOCC4
ETHYL5METHYL2((((4(MORPHOLIN4YLCARBONYL)PHENYL)AMINO)THIOXOMETHYL)AMINO)4PHENYLTHIOPHENE3CARBOXYLATE
ethyl5methyl2(((4(morpholin4ylcarbonyl)phenyl)carbamothioyl)amino)4phenylthiophene3carboxylate
ETHYL5METHYL2((4(MORPHOLINE4CARBONYL)PHENYL)CARBAMOTHIOYLAMINO)4PHENYLTHIOPHENE3CARBOXYLATE
InChI=1SC26H27N3O4S2c133325(31)2221(187546818)17(2)3523(22)2826(34)272011919(101220)24(30)29131532161429h412H31316H212H3(H2272834)
MFCD04137034
ZINC000016345771
ZINC16345771

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.