Vitas-M small molecule compound

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

Catalog ID
STK316223
SMILES CCCOC(=O)c1c(sc(c1c1ccc(cc1)CCCC)C)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 C30H32N2O4S MW 516.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H32N2O4S/c1-5-7-11-21-14-16-22(17-15-21)25-20(4)37-29(26(25)30(34)35-18-6-2)31-28(33)24-19(3)36-32-27(24)23-12-9-8-10-13-23/h8-10,12-17H,5-7,11,18H2,1-4H3,(H,31,33)
InChIKey
DFYZLZBBOSFNFP-UHFFFAOYSA-N
Synonyms
514837-82-2
514837822
CCCCC1=CC=C(C=C1)C2=C(SC(=C2C(=O)OCCC)NC(=O)C3=C(ON=C3C4=CC=CC=C4)C)C
InChI=1SC30H32N2O4Sc1571121141622(171521)2520(4)3729(26(25)30(34)351862)3128(33)2419(3)363227(24)231298101323h8101217H571118H214H3(H3133)
MFCD03757626
propyl4(4butylphenyl)5methyl2(((5methyl3phenyl12oxazol4yl)carbonyl)amino)thiophene3carboxylate
PROPYL4(4BUTYLPHENYL)5METHYL2(((5METHYL3PHENYL4ISOXAZOLYL)CARBONYL)AMINO)3THIOPHENECARBOXYLATE
PROPYL4(4BUTYLPHENYL)5METHYL2((5METHYL3PHENYL12OXAZOLE4CARBONYL)AMINO)THIOPHENE3CARBOXYLATE
ZINC000002091307
ZINC02091307
ZINC2091307

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Available files

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