Vitas-M small molecule compound
propan-2-yl 5-[(2,4-dimethylphenyl)carbamoyl]-4-methyl-2-{[(2-oxo-2H-chromen-3-yl)carbonyl]amino}thiophene-3-carboxylate
Catalog ID
STK451942
SMILES CC(OC(=O)c1c(sc(c1C)C(=O)Nc1ccc(cc1C)C)NC(=O)c1cc2ccccc2oc1=O)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 C28H26N2O6S MW 518.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H26N2O6S/c1-14(2)35-28(34)22-17(5)23(25(32)29-20-11-10-15(3)12-16(20)4)37-26(22)30-24(31)19-13-18-8-6-7-9-21(18)36-27(19)33/h6-14H,1-5H3,(H,29,32)(H,30,31)InChIKey
KINWFXCDUASZEE-UHFFFAOYSA-NSynonyms
CC1=CC(=C(C=C1)NC(=O)C2=C(C(=C(S2)NC(=O)C3=CC4=CC=CC=C4OC3=O)C(=O)OC(C)C)C)C
InChI=1SC28H26N2O6Sc114(2)3528(34)2217(5)23(25(32)2920111015(3)1216(20)4)3726(22)3024(31)191318867921(18)3627(19)33h614H15H3(H2932)(H3031)
ISOPROPYL5((24DIMETHYLANILINO)CARBONYL)4METHYL2(((2OXO2HCHROMEN3YL)CARBONYL)AMINO)3THIOPHENECARBOXYLATE
METHYLETHYL5(N(24DIMETHYLPHENYL)CARBAMOYL)4METHYL2((2OXOCHROMEN3YL)CARBONYLAMINO)THIOPHENE3CARBOXYLATE
MFCD02607180
propan2yl5((24dimethylphenyl)carbamoyl)4methyl2(((2oxo2Hchromen3yl)carbonyl)amino)thiophene3carboxylate
PROPAN2YL5((24DIMETHYLPHENYL)CARBAMOYL)4METHYL2((2OXOCHROMENE3CARBONYL)AMINO)THIOPHENE3CARBOXYLATE
ZINC000000689036
ZINC00689036
ZINC689036
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