Vitas-M small molecule compound
3-phenylpropyl 5-[({4-[(4-methylpiperidin-1-yl)sulfonyl]phenyl}carbamothioyl)amino]-5-oxopentanoate
Catalog ID
STL065277
SMILES CC1CCN(CC1)S(=O)(=O)c1ccc(cc1)NC(=S)NC(=O)CCCC(=O)OCCCc1ccccc1
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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 C27H35N3O5S2 MW 545.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H35N3O5S2/c1-21-16-18-30(19-17-21)37(33,34)24-14-12-23(13-15-24)28-27(36)29-25(31)10-5-11-26(32)35-20-6-9-22-7-3-2-4-8-22/h2-4,7-8,12-15,21H,5-6,9-11,16-20H2,1H3,(H2,28,29,31,36)InChIKey
MXBLHVURMPGMHG-UHFFFAOYSA-NSynonyms
3phenylpropyl5(((4((4methylpiperidin1yl)sulfonyl)phenyl)carbamothioyl)amino)5oxopentanoate
3PHENYLPROPYL5((4(4METHYLPIPERIDIN1YL)SULFONYLPHENYL)CARBAMOTHIOYLAMINO)5OXOPENTANOATE
CC1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC(=S)NC(=O)CCCC(=O)OCCCC3=CC=CC=C3
InChI=1SC27H35N3O5S2c121161830(191721)37(3334)24141223(131524)2827(36)2925(31)1051126(32)352069227324822h2478121521H569111620H21H3(H228293136)
MFCD07083662
ZINC000097940415
ZINC97940415
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