Vitas-M small molecule compound

methyl 6-tert-butyl-2-{[(3-chloro-1-benzothiophen-2-yl)carbonyl]amino}-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Catalog ID
STK315819
SMILES COC(=O)c1c(sc2c1CCC(C2)C(C)(C)C)NC(=O)c1sc2c(c1Cl)cccc2

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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 C23H24ClNO3S2 MW 462.03 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H24ClNO3S2/c1-23(2,3)12-9-10-13-16(11-12)30-21(17(13)22(27)28-4)25-20(26)19-18(24)14-7-5-6-8-15(14)29-19/h5-8,12H,9-11H2,1-4H3,(H,25,26)
InChIKey
KBZSVLSQXXVPCN-UHFFFAOYSA-N
Synonyms
309726-67-8
309726678
CC(C)(C)C1CCC2=C(C1)SC(=C2C(=O)OC)NC(=O)C3=C(C4=CC=CC=C4S3)Cl
InChI=1SC23H24ClNO3S2c123(23)129101316(1112)3021(17(13)22(27)284)2520(26)1918(24)14756815(14)2919h5812H911H214H3(H2526)
methyl6tertbutyl2(((3chloro1benzothiophen2yl)carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
methyl6tertbutyl2((3chloro1benzothiophene2carbonyl)amino)4567tetrahydro1benzothiophene3carboxylate
MFCD01872071
ZINC000002754227
ZINC000002754228

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Available files

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