Vitas-M small molecule compound
10a-{(E)-2-[3-(3-chloro-4-methoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]ethenyl}-8,10,10-trimethyl-3,4,10,10a-tetrahydropyrimido[1,2-a]indol-2(1H)-one
Catalog ID
STL007294
SMILES COc1ccc(cc1Cl)c1nn(cc1/C=C/C12NC(=O)CCN1c1c(C2(C)C)cc(cc1)C)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 C32H31ClN4O2 MW 539.08 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H31ClN4O2/c1-21-10-12-27-25(18-21)31(2,3)32(34-29(38)15-17-36(27)32)16-14-23-20-37(24-8-6-5-7-9-24)35-30(23)22-11-13-28(39-4)26(33)19-22/h5-14,16,18-20H,15,17H2,1-4H3,(H,34,38)/b16-14+InChIKey
HCJGKPIHAIQBRY-JQIJEIRASA-NSynonyms
(E)10a(2(3(3chloro4methoxyphenyl)1phenyl1Hpyrazol4yl)vinyl)81010trimethyl341010atetrahydropyrimido(12a)indol2(1H)one
10a((E)2(3(3chloro4methoxyphenyl)1phenyl1Hpyrazol4yl)ethenyl)81010trimethyl341010atetrahydropyrimido(12a)indol2(1H)one
10a((E)2(3(3chloro4methoxyphenyl)1phenylpyrazol4yl)ethenyl)81010trimethyl34dihydro1Hpyrimido(12a)indol2one
CC1=CC2=C(C=C1)N3CCC(=O)NC3(C2(C)C)C=CC4=CN(N=C4C5=CC(=C(C=C5)OC)Cl)C6=CC=CC=C6
COc1ccc(cc1Cl)c1nn(cc1C=CC12NC(=O)CCN1c1c(C2(C)C)cc(cc1)C)c1ccccc1
InChI=1SC32H31ClN4O2c12110122725(1821)31(23)32(3429(38)151736(27)32)1614232037(248657924)3530(23)22111328(394)26(33)1922h514161820H1517H214H3(H3438)b1614+
ZINC000101308505
ZINC000101308509
Check stock
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