Vitas-M small molecule compound
N-[(1Z)-1-[1-(dimethylsulfamoyl)-1H-indol-3-yl]-3-{[2-(6-fluoro-1H-indol-3-yl)ethyl]amino}-3-oxoprop-1-en-2-yl]-4-methylbenzamide
Catalog ID
STL440647
SMILES Cc1ccc(cc1)C(=O)N/C(=C\c1cn(c2c1cccc2)S(=O)(=O)N(C)C)/C(=O)NCCc1c[nH]c2c1ccc(c2)F
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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 C31H30FN5O4S MW 587.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H30FN5O4S/c1-20-8-10-21(11-9-20)30(38)35-28(31(39)33-15-14-22-18-34-27-17-24(32)12-13-25(22)27)16-23-19-37(42(40,41)36(2)3)29-7-5-4-6-26(23)29/h4-13,16-19,34H,14-15H2,1-3H3,(H,33,39)(H,35,38)/b28-16-InChIKey
OWTHVIHYAANCGQ-NTFVMDSBSA-NSynonyms
CC1=CC=C(C=C1)C(=O)NC(=CC2=CN(C3=CC=CC=C32)S(=O)(=O)N(C)C)C(=O)NCCC4=CNC5=C4C=CC(=C5)F
Cc1ccc(cc1)C(=O)NC(=Cc1cn(c2c1cccc2)S(=O)(=O)N(C)C)C(=O)NCCc1c(nH)c2c1ccc(c2)F
InChI=1SC31H30FN5O4Sc12081021(11920)30(38)3528(31(39)331514221834271724(32)121325(22)27)16231937(42(4041)36(2)3)29754626(23)29h413161934H1415H213H3(H3339)(H3538)b2816
MFCD09992464
N((1Z)1(1(dimethylsulfamoyl)1Hindol3yl)3((2(6fluoro1Hindol3yl)ethyl)amino)3oxoprop1en2yl)4methylbenzamide
N((Z)1(1(dimethylsulfamoyl)indol3yl)3(2(6fluoro1Hindol3yl)ethylamino)3oxoprop1en2yl)4methylbenzamide
ZINC000101382126
ZINC101382126
Check stock
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Check stock on Vitas-MAvailable files
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