Vitas-M small molecule compound
N-{(1Z)-3-{[3-(dimethylamino)propyl]amino}-1-[3-(4-iodophenyl)-1-phenyl-1H-pyrazol-4-yl]-3-oxoprop-1-en-2-yl}-4-methylbenzamide
Catalog ID
STK983107
SMILES CN(CCCNC(=O)/C(=C/c1cn(nc1c1ccc(cc1)I)c1ccccc1)/NC(=O)c1ccc(cc1)C)C
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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 C31H32IN5O2 MW 633.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H32IN5O2/c1-22-10-12-24(13-11-22)30(38)34-28(31(39)33-18-7-19-36(2)3)20-25-21-37(27-8-5-4-6-9-27)35-29(25)23-14-16-26(32)17-15-23/h4-6,8-17,20-21H,7,18-19H2,1-3H3,(H,33,39)(H,34,38)/b28-20-InChIKey
OOLOCZDFEWSARE-RRAHZORUSA-NSynonyms
(2Z)N(3(DIMETHYLAMINO)PROPYL)3(3(4IODOPHENYL)1PHENYLPYRAZOL4YL)2((4METHYLPHENYL)CARBONYLAMINO)PROP2ENAMIDE
CC1=CC=C(C=C1)C(=O)NC(=CC2=CN(N=C2C3=CC=C(C=C3)I)C4=CC=CC=C4)C(=O)NCCCN(C)C
CN(CCCNC(=O)C(=Cc1cn(nc1c1ccc(cc1)I)c1ccccc1)NC(=O)c1ccc(cc1)C)C
InChI=1SC31H32IN5O2c122101224(131122)30(38)3428(31(39)331871936(2)3)20252137(278546927)3529(25)23141626(32)171523h468172021H71819H213H3(H3339)(H3438)b2820
MFCD03650962
N((1Z)3((3(dimethylamino)propyl)amino)1(3(4iodophenyl)1phenyl1Hpyrazol4yl)3oxoprop1en2yl)4methylbenzamide
N((Z)3(3(DIMETHYLAMINO)PROPYLAMINO)1(3(4IODOPHENYL)1PHENYLPYRAZOL4YL)3OXOPROP1EN2YL)4METHYLBENZAMIDE
ZINC000097947567
ZINC97947567
Check stock
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Check stock on Vitas-MAvailable files
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