Vitas-M small molecule compound
6-({3-[(pyridin-3-ylmethyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl}carbamoyl)cyclohex-3-ene-1-carboxylic acid
Catalog ID
STK464196
SMILES O=C(C1CC=CCC1C(=O)O)Nc1sc2c(c1C(=O)NCc1cccnc1)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 C23H25N3O4S MW 439.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25N3O4S/c27-20(15-7-1-2-8-16(15)23(29)30)26-22-19(17-9-3-4-10-18(17)31-22)21(28)25-13-14-6-5-11-24-12-14/h1-2,5-6,11-12,15-16H,3-4,7-10,13H2,(H,25,28)(H,26,27)(H,29,30)InChIKey
HTBJJTSIHZEUCY-UHFFFAOYSA-NSynonyms
6((3((pyridin3ylmethyl)carbamoyl)4567tetrahydro1benzothiophen2yl)carbamoyl)cyclohex3ene1carboxylicacid
6((3(pyridin3ylmethylcarbamoyl)4567tetrahydro1benzothiophen2yl)carbamoyl)cyclohex3ene1carboxylicacid
C1CCC2=C(C1)C(=C(S2)NC(=O)C3CC=CCC3C(=O)O)C(=O)NCC4=CN=CC=C4
InChI=1SC23H25N3O4Sc2720(15712816(15)23(29)30)262219(179341018(17)3122)21(28)2513146511241214h125611121516H3471013H2(H2528)(H2627)(H2930)
MFCD06021304
ZINC000019630021
ZINC000019630033
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