Vitas-M small molecule compound
propan-2-yl 4-(4-butylphenyl)-2-{[(6-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophen-3-yl)carbonyl]amino}-5-methylthiophene-3-carboxylate
Catalog ID
STK431993
SMILES CCCCc1ccc(cc1)c1c(C)sc(c1C(=O)OC(C)C)NC(=O)c1csc2c1CCC(C2)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 C32H41NO3S2 MW 551.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H41NO3S2/c1-8-9-10-21-11-13-22(14-12-21)27-20(4)38-30(28(27)31(35)36-19(2)3)33-29(34)25-18-37-26-17-23(32(5,6)7)15-16-24(25)26/h11-14,18-19,23H,8-10,15-17H2,1-7H3,(H,33,34)InChIKey
XZOQNKBSMIQNCH-UHFFFAOYSA-NSynonyms
CCCCC1=CC=C(C=C1)C2=C(SC(=C2C(=O)OC(C)C)NC(=O)C3=CSC4=C3CCC(C4)C(C)(C)C)C
InChI=1SC32H41NO3S2c1891021111322(141221)2720(4)3830(28(27)31(35)3619(2)3)3329(34)251837261723(32(56)7)151624(25)26h1114181923H8101517H217H3(H3334)
MFCD03466414
propan2yl4(4butylphenyl)2(((6tertbutyl4567tetrahydro1benzothiophen3yl)carbonyl)amino)5methylthiophene3carboxylate
propan2yl4(4butylphenyl)2((6tertbutyl4567tetrahydro1benzothiophene3carbonyl)amino)5methylthiophene3carboxylate
ZINC000002749644
ZINC000002749645
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