Vitas-M small molecule compound

6-{[3-(cyclohexylcarbamoyl)-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]carbamoyl}cyclohex-3-ene-1-carboxylic acid

Catalog ID
STK470750
SMILES CC1CCc2c(C1)sc(c2C(=O)NC1CCCCC1)NC(=O)C1CC=CCC1C(=O)O

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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 C24H32N2O4S MW 444.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H32N2O4S/c1-14-11-12-18-19(13-14)31-23(20(18)22(28)25-15-7-3-2-4-8-15)26-21(27)16-9-5-6-10-17(16)24(29)30/h5-6,14-17H,2-4,7-13H2,1H3,(H,25,28)(H,26,27)(H,29,30)
InChIKey
RRMPMONTFVXXLA-UHFFFAOYSA-N
Synonyms

6((3(cyclohexylcarbamoyl)6methyl4567tetrahydro1benzothiophen2yl)carbamoyl)cyclohex3ene1carboxylicacid
CC1CCC2=C(C1)SC(=C2C(=O)NC3CCCCC3)NC(=O)C4CC=CCC4C(=O)O
InChI=1SC24H32N2O4Sc11411121819(1314)3123(20(18)22(28)25157324815)2621(27)169561017(16)24(29)30h561417H24713H21H3(H2528)(H2627)(H2930)
MFCD06021582
ZINC000019641783
ZINC000239403273

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Available files

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