Vitas-M small molecule compound

N-(4-methoxybenzyl)-1-[7-(4-methylphenyl)-4-oxo-3,4-dihydrothieno[3,2-d]pyrimidin-2-yl]piperidine-3-carboxamide

Catalog ID
STL097528
SMILES COc1ccc(cc1)CNC(=O)C1CCCN(C1)c1nc2c(csc2c(=O)[nH]1)c1ccc(cc1)C

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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 C27H28N4O3S MW 488.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28N4O3S/c1-17-5-9-19(10-6-17)22-16-35-24-23(22)29-27(30-26(24)33)31-13-3-4-20(15-31)25(32)28-14-18-7-11-21(34-2)12-8-18/h5-12,16,20H,3-4,13-15H2,1-2H3,(H,28,32)(H,29,30,33)
InChIKey
YZTNFPTZHLIJMQ-UHFFFAOYSA-N
Synonyms
1243105-75-0
1243105750
CC1=CC=C(C=C1)C2=CSC3=C2NC(=NC3=O)N4CCCC(C4)C(=O)NCC5=CC=C(C=C5)OC
COc1ccc(cc1)CNC(=O)C1CCCN(C1)c1nc2c(csc2c(=O)(nH)1)c1ccc(cc1)C
InChI=1SC27H28N4O3Sc1175919(10617)2216352423(22)2927(3026(24)33)31133420(1531)25(32)28141871121(342)12818h5121620H341315H212H3(H2832)(H293033)
MFCD18789201
N((4methoxyphenyl)methyl)1(7(4methylphenyl)4oxo1Hthieno(32d)pyrimidin2yl)piperidine3carboxamide
N(4METHOXYBENZYL)1(4OXO7(PTOLYL)34DIHYDROTHIENO(32D)PYRIMIDIN2YL)PIPERIDINE3CARBOXAMIDE
N(4methoxybenzyl)1(7(4methylphenyl)4oxo34dihydrothieno(32d)pyrimidin2yl)piperidine3carboxamide
ZINC000049421280
ZINC000049421281

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.