Vitas-M small molecule compound

ethyl 5-{[4-(ethoxycarbonyl)phenyl]carbamoyl}-4-methyl-2-[(phenylcarbonyl)amino]thiophene-3-carboxylate

Catalog ID
STK029113
SMILES CCOC(=O)c1c(sc(c1C)C(=O)Nc1ccc(cc1)C(=O)OCC)NC(=O)c1ccccc1

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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 C25H24N2O6S MW 480.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24N2O6S/c1-4-32-24(30)17-11-13-18(14-12-17)26-22(29)20-15(3)19(25(31)33-5-2)23(34-20)27-21(28)16-9-7-6-8-10-16/h6-14H,4-5H2,1-3H3,(H,26,29)(H,27,28)
InChIKey
UCTLICHRPCPTDZ-UHFFFAOYSA-N
Synonyms

CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=C(C(=C(S2)NC(=O)C3=CC=CC=C3)C(=O)OCC)C
CCOC(=O)c1c(sc(c1C)C(=O)Nc1ccc(cc1)C(=O)OCC)NC(=O)c1ccccc1
ETHYL2(BENZOYLAMINO)5((4(ETHOXYCARBONYL)ANILINO)CARBONYL)4METHYL3THIOPHENECARBOXYLATE
ETHYL2BENZAMIDO5((4ETHOXYCARBONYLPHENYL)CARBAMOYL)4METHYLTHIOPHENE3CARBOXYLATE
ETHYL4((4(ETHOXYCARBONYL)3METHYL5(PHENYLCARBONYLAMINO)2THIENYL)CARBONYLAMINO)BENZOATE
ETHYL5((4(ETHOXYCARBONYL)PHENYL)CARBAMOYL)4METHYL2((PHENYLCARBONYL)AMINO)THIOPHENE3CARBOXYLATE
InChI=1SC25H24N2O6Sc143224(30)17111318(141217)2622(29)2015(3)19(25(31)3352)23(3420)2721(28)1697681016h614H45H213H3(H2629)(H2728)
MFCD01151635
STK029113
ZINC000000647579
ZINC00647579
ZINC647579

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Available files

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