Vitas-M small molecule compound
N-(1,3-benzodioxol-5-ylmethyl)-1-(4-methylbenzyl)-2,4-dioxo-3-(prop-2-en-1-yl)-1,2,3,4-tetrahydroquinazoline-7-carboxamide
Catalog ID
STL124835
SMILES C=CCn1c(=O)n(Cc2ccc(cc2)C)c2c(c1=O)ccc(c2)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 C28H25N3O5 MW 483.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H25N3O5/c1-3-12-30-27(33)22-10-9-21(26(32)29-15-20-8-11-24-25(13-20)36-17-35-24)14-23(22)31(28(30)34)16-19-6-4-18(2)5-7-19/h3-11,13-14H,1,12,15-17H2,2H3,(H,29,32)InChIKey
AAJPCBLLZNKAIN-UHFFFAOYSA-NSynonyms
CC1=CC=C(C=C1)CN2C3=C(C=CC(=C3)C(=O)NCC4=CC5=C(C=C4)OCO5)C(=O)N(C2=O)CC=C
InChI=1SC28H25N3O5c13123027(33)2210921(26(32)2915208112425(1320)36173524)1423(22)31(28(30)34)16196418(2)5719h3111314H1121517H22H3(H2932)
MFCD14761484
N(13benzodioxol5ylmethyl)1((4methylphenyl)methyl)24dioxo3prop2enylquinazoline7carboxamide
N(13benzodioxol5ylmethyl)1(4methylbenzyl)24dioxo3(prop2en1yl)1234tetrahydroquinazoline7carboxamide
ZINC000009692717
ZINC9692717
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