Vitas-M small molecule compound

N-(1,3-benzodioxol-5-ylmethyl)-5-[1-(4-methylbenzyl)-2,4-dioxo-1,4-dihydroquinazolin-3(2H)-yl]pentanamide

Catalog ID
STL131550
SMILES O=C(NCc1ccc2c(c1)OCO2)CCCCn1c(=O)n(Cc2ccc(cc2)C)c2c(c1=O)cccc2

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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 C29H29N3O5 MW 499.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H29N3O5/c1-20-9-11-21(12-10-20)18-32-24-7-3-2-6-23(24)28(34)31(29(32)35)15-5-4-8-27(33)30-17-22-13-14-25-26(16-22)37-19-36-25/h2-3,6-7,9-14,16H,4-5,8,15,17-19H2,1H3,(H,30,33)
InChIKey
AICVRJBCWNZORD-UHFFFAOYSA-N
Synonyms
899787-70-3
899787703
CC1=CC=C(C=C1)CN2C3=CC=CC=C3C(=O)N(C2=O)CCCCC(=O)NCC4=CC5=C(C=C4)OCO5
InChI=1SC29H29N3O5c12091121(121020)183224732623(24)28(34)31(29(32)35)1554827(33)30172213142526(1622)37193625h236791416H458151719H21H3(H3033)
MFCD14738164
N(13benzodioxol5ylmethyl)5(1((4methylphenyl)methyl)24dioxoquinazolin3yl)pentanamide
N(13benzodioxol5ylmethyl)5(1(4methylbenzyl)24dioxo14dihydroquinazolin3(2H)yl)pentanamide
N(BENZO(D)(13)DIOXOL5YLMETHYL)5(1(4METHYLBENZYL)24DIOXO12DIHYDROQUINAZOLIN3(4H)YL)PENTANAMIDE
ZINC000008593420
ZINC08593420
ZINC8593420

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Available files

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