Vitas-M small molecule compound
N-benzyl-1-{2-[(4-methoxyphenyl)amino]-2-oxoethyl}-2,4-dioxo-3-(prop-2-en-1-yl)-1,2,3,4-tetrahydroquinazoline-7-carboxamide
Catalog ID
STL134990
SMILES C=CCn1c(=O)n(CC(=O)Nc2ccc(cc2)OC)c2c(c1=O)ccc(c2)C(=O)NCc1ccccc1
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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 C28H26N4O5 MW 498.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H26N4O5/c1-3-15-31-27(35)23-14-9-20(26(34)29-17-19-7-5-4-6-8-19)16-24(23)32(28(31)36)18-25(33)30-21-10-12-22(37-2)13-11-21/h3-14,16H,1,15,17-18H2,2H3,(H,29,34)(H,30,33)InChIKey
MUJUTDQZUAWTEL-UHFFFAOYSA-NSynonyms
902161-98-2902161982
COC1=CC=C(C=C1)NC(=O)CN2C3=C(C=CC(=C3)C(=O)NCC4=CC=CC=C4)C(=O)N(C2=O)CC=C
InChI=1SC28H26N4O5c13153127(35)2314920(26(34)2917197546819)1624(23)32(28(31)36)1825(33)3021101222(372)131121h31416H1151718H22H3(H2934)(H3033)
MFCD07655566
Nbenzyl1(2((4methoxyphenyl)amino)2oxoethyl)24dioxo3(prop2en1yl)1234tetrahydroquinazoline7carboxamide
Nbenzyl1(2(4methoxyanilino)2oxoethyl)24dioxo3prop2enylquinazoline7carboxamide
ZINC000009692729
ZINC09692729
ZINC9692729
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