Vitas-M small molecule compound
N-[(1Z)-1-[1-(dimethylsulfamoyl)-1H-indol-3-yl]-3-{[3-(morpholin-4-yl)propyl]amino}-3-oxoprop-1-en-2-yl]-4-methoxybenzamide
Catalog ID
STL445182
SMILES COc1ccc(cc1)C(=O)N/C(=C\c1cn(c2c1cccc2)S(=O)(=O)N(C)C)/C(=O)NCCCN1CCOCC1
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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 C28H35N5O6S MW 569.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H35N5O6S/c1-31(2)40(36,37)33-20-22(24-7-4-5-8-26(24)33)19-25(30-27(34)21-9-11-23(38-3)12-10-21)28(35)29-13-6-14-32-15-17-39-18-16-32/h4-5,7-12,19-20H,6,13-18H2,1-3H3,(H,29,35)(H,30,34)/b25-19-InChIKey
ITZXPXWRCUFQHJ-PLRJNAJWSA-NSynonyms
CN(C)S(=O)(=O)N1C=C(C2=CC=CC=C21)C=C(C(=O)NCCCN3CCOCC3)NC(=O)C4=CC=C(C=C4)OC
COc1ccc(cc1)C(=O)NC(=Cc1cn(c2c1cccc2)S(=O)(=O)N(C)C)C(=O)NCCCN1CCOCC1
InChI=1SC28H35N5O6Sc131(2)40(3637)332022(24745826(24)33)1925(3027(34)2191123(383)121021)28(35)291361432151739181632h457121920H61318H213H3(H2935)(H3034)b2519
MFCD06240891
N((1Z)1(1(dimethylsulfamoyl)1Hindol3yl)3((3(morpholin4yl)propyl)amino)3oxoprop1en2yl)4methoxybenzamide
N((Z)1(1(DIMETHYLSULFAMOYL)INDOL3YL)3(3MORPHOLIN4YLPROPYLAMINO)3OXOPROP1EN2YL)4METHOXYBENZAMIDE
ZINC000038152818
ZINC38152818
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