Vitas-M small molecule compound

2,4-dichloro-N-{(1Z)-1-[3-(4-chlorophenyl)-1-phenyl-1H-pyrazol-4-yl]-3-oxo-3-[(pyridin-2-ylmethyl)amino]prop-1-en-2-yl}benzamide

Catalog ID
STK695729
SMILES Clc1ccc(cc1)c1nn(cc1/C=C(/C(=O)NCc1ccccn1)\NC(=O)c1ccc(cc1Cl)Cl)c1ccccc1

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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 C31H22Cl3N5O2 MW 602.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H22Cl3N5O2/c32-22-11-9-20(10-12-22)29-21(19-39(38-29)25-7-2-1-3-8-25)16-28(31(41)36-18-24-6-4-5-15-35-24)37-30(40)26-14-13-23(33)17-27(26)34/h1-17,19H,18H2,(H,36,41)(H,37,40)/b28-16-
InChIKey
XRSZCNHXBAGBNH-NTFVMDSBSA-N
Synonyms

(2Z)2((24DICHLOROPHENYL)CARBONYLAMINO)3(3(4CHLOROPHENYL)1PHENYLPYRAZOL4YL)N(2PYRIDYLMETHYL)PROP2ENAMIDE
24dichloroN((1Z)1(3(4chlorophenyl)1phenyl1Hpyrazol4yl)3oxo3((pyridin2ylmethyl)amino)prop1en2yl)benzamide
24DICHLORON((Z)1(3(4CHLOROPHENYL)1PHENYLPYRAZOL4YL)3OXO3(PYRIDIN2YLMETHYLAMINO)PROP1EN2YL)BENZAMIDE
C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=C(C=C3)Cl)C=C(C(=O)NCC4=CC=CC=N4)NC(=O)C5=C(C=C(C=C5)Cl)Cl
Clc1ccc(cc1)c1nn(cc1C=C(C(=O)NCc1ccccn1)NC(=O)c1ccc(cc1Cl)Cl)c1ccccc1
InChI=1SC31H22Cl3N5O2c322211920(101222)2921(1939(3829)257213825)1628(31(41)361824645153524)3730(40)26141323(33)1727(26)34h11719H18H2(H3641)(H3740)b2816
MFCD01819598
ZINC000100080788
ZINC100080788

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Available files

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