Vitas-M small molecule compound
N-(1,3-benzodioxol-5-ylmethyl)-2,4-dioxo-3-(prop-2-en-1-yl)-1-(2,4,6-trimethylbenzyl)-1,2,3,4-tetrahydroquinazoline-7-carboxamide
Catalog ID
STL134977
SMILES C=CCn1c(=O)c2ccc(cc2n(c1=O)Cc1c(C)cc(cc1C)C)C(=O)NCc1ccc2c(c1)OCO2
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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 C30H29N3O5 MW 511.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H29N3O5/c1-5-10-32-29(35)23-8-7-22(28(34)31-15-21-6-9-26-27(13-21)38-17-37-26)14-25(23)33(30(32)36)16-24-19(3)11-18(2)12-20(24)4/h5-9,11-14H,1,10,15-17H2,2-4H3,(H,31,34)InChIKey
ZWELSPGMKBKGRZ-UHFFFAOYSA-NSynonyms
893787-10-5893787105
CC1=CC(=C(C(=C1)C)CN2C3=C(C=CC(=C3)C(=O)NCC4=CC5=C(C=C4)OCO5)C(=O)N(C2=O)CC=C)C
InChI=1SC30H29N3O5c15103229(35)238722(28(34)311521692627(1321)38173726)1425(23)33(30(32)36)162419(3)1118(2)1220(24)4h591114H1101517H224H3(H3134)
MFCD08568908
N(13benzodioxol5ylmethyl)24dioxo3(prop2en1yl)1(246trimethylbenzyl)1234tetrahydroquinazoline7carboxamide
N(13benzodioxol5ylmethyl)24dioxo3prop2enyl1((246trimethylphenyl)methyl)quinazoline7carboxamide
ZINC000008756797
ZINC08756797
ZINC8756797
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