Vitas-M small molecule compound

methyl 4-(4-butylphenyl)-2-{[(5-methyl-3-phenyl-1,2-oxazol-4-yl)carbonyl]amino}thiophene-3-carboxylate

Catalog ID
STK451621
SMILES CCCCc1ccc(cc1)c1csc(c1C(=O)OC)NC(=O)c1c(C)onc1c1ccccc1

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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 C27H26N2O4S MW 474.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26N2O4S/c1-4-5-9-18-12-14-19(15-13-18)21-16-34-26(23(21)27(31)32-3)28-25(30)22-17(2)33-29-24(22)20-10-7-6-8-11-20/h6-8,10-16H,4-5,9H2,1-3H3,(H,28,30)
InChIKey
UHBYGCMWLJTKNF-UHFFFAOYSA-N
Synonyms

CCCCC1=CC=C(C=C1)C2=CSC(=C2C(=O)OC)NC(=O)C3=C(ON=C3C4=CC=CC=C4)C
InChI=1SC27H26N2O4Sc145918121419(151318)21163426(23(21)27(31)323)2825(30)2217(2)332924(22)20107681120h681016H459H213H3(H2830)
methyl4(4butylphenyl)2(((5methyl3phenyl12oxazol4yl)carbonyl)amino)thiophene3carboxylate
METHYL4(4BUTYLPHENYL)2(((5METHYL3PHENYL4ISOXAZOLYL)CARBONYL)AMINO)3THIOPHENECARBOXYLATE
METHYL4(4BUTYLPHENYL)2((5METHYL3PHENYL12OXAZOLE4CARBONYL)AMINO)THIOPHENE3CARBOXYLATE
METHYL4(4BUTYLPHENYL)2((5METHYL3PHENYLISOXAZOL4YL)CARBONYLAMINO)THIOPHENE3CARBOXYLATE
MFCD03070942
ZINC000002089640
ZINC02089640
ZINC2089640

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Available files

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