Vitas-M small molecule compound

propan-2-yl 2-{[(6-tert-butyl-4,5,6,7-tetrahydro-1-benzothiophen-3-yl)carbonyl]amino}-5-[(2-methoxyphenyl)carbamoyl]-4-methylthiophene-3-carboxylate

Catalog ID
STK431666
SMILES COc1ccccc1NC(=O)c1sc(c(c1C)C(=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 C30H36N2O5S2 MW 568.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H36N2O5S2/c1-16(2)37-29(35)24-17(3)25(27(34)31-21-10-8-9-11-22(21)36-7)39-28(24)32-26(33)20-15-38-23-14-18(30(4,5)6)12-13-19(20)23/h8-11,15-16,18H,12-14H2,1-7H3,(H,31,34)(H,32,33)
InChIKey
HIXQTRUQKDYACY-UHFFFAOYSA-N
Synonyms

CC1=C(SC(=C1C(=O)OC(C)C)NC(=O)C2=CSC3=C2CCC(C3)C(C)(C)C)C(=O)NC4=CC=CC=C4OC
InChI=1SC30H36N2O5S2c116(2)3729(35)2417(3)25(27(34)312110891122(21)367)3928(24)3226(33)201538231418(30(45)6)121319(20)23h811151618H1214H217H3(H3134)(H3233)
MFCD03075012
propan2yl2(((6tertbutyl4567tetrahydro1benzothiophen3yl)carbonyl)amino)5((2methoxyphenyl)carbamoyl)4methylthiophene3carboxylate
propan2yl2((6tertbutyl4567tetrahydro1benzothiophene3carbonyl)amino)5((2methoxyphenyl)carbamoyl)4methylthiophene3carboxylate
ZINC000002112223
ZINC000002112226

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Available files

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