Vitas-M small molecule compound

propan-2-yl 4-(4-tert-butylphenyl)-2-({[2-(3-ethoxyphenyl)quinolin-4-yl]carbonyl}amino)-5-methylthiophene-3-carboxylate

Catalog ID
STK423662
SMILES CCOc1cccc(c1)c1nc2ccccc2c(c1)C(=O)Nc1sc(c(c1C(=O)OC(C)C)c1ccc(cc1)C(C)(C)C)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 C37H38N2O4S MW 606.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C37H38N2O4S/c1-8-42-27-13-11-12-25(20-27)31-21-29(28-14-9-10-15-30(28)38-31)34(40)39-35-33(36(41)43-22(2)3)32(23(4)44-35)24-16-18-26(19-17-24)37(5,6)7/h9-22H,8H2,1-7H3,(H,39,40)
InChIKey
IYLBSUPBUFYBKY-UHFFFAOYSA-N
Synonyms

1METHYLETHYL4(4TERTBUTYLPHENYL)2(((2(3ETHOXYPHENYL)QUINOLIN4YL)CARBONYL)AMINO)5METHYLTHIOPHENE3CARBOXYLATE
CCOC1=CC=CC(=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=C(C(=C(S4)C)C5=CC=C(C=C5)C(C)(C)C)C(=O)OC(C)C
InChI=1SC37H38N2O4Sc18422713111225(2027)312129(28149101530(28)3831)34(40)393533(36(41)4322(2)3)32(23(4)4435)24161826(191724)37(56)7h922H8H217H3(H3940)
METHYLETHYL4(4(TERTBUTYL)PHENYL)2((2(3ETHOXYPHENYL)(4QUINOLYL))CARBONYLAMINO)5METHYLTHIOPHENE3CARBOXYLATE
MFCD02056366
propan2yl4(4tertbutylphenyl)2(((2(3ethoxyphenyl)quinolin4yl)carbonyl)amino)5methylthiophene3carboxylate
PROPAN2YL4(4TERTBUTYLPHENYL)2((2(3ETHOXYPHENYL)QUINOLINE4CARBONYL)AMINO)5METHYLTHIOPHENE3CARBOXYLATE
ZINC000097948847
ZINC97948847

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Available files

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