Vitas-M small molecule compound

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

Catalog ID
STL097570
SMILES COc1cccc(c1)CNC(=O)C1CCN(CC1)c1nc2c(csc2c(=O)[nH]1)c1cccc(c1)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/c1-17-5-3-7-20(13-17)22-16-35-24-23(22)29-27(30-26(24)33)31-11-9-19(10-12-31)25(32)28-15-18-6-4-8-21(14-18)34-2/h3-8,13-14,16,19H,9-12,15H2,1-2H3,(H,28,32)(H,29,30,33)
InChIKey
AFJLSMPMJKDPHI-UHFFFAOYSA-N
Synonyms
1242984-33-3
1242984333
CC1=CC=CC(=C1)C2=CSC3=C2NC(=NC3=O)N4CCC(CC4)C(=O)NCC5=CC(=CC=C5)OC
COc1cccc(c1)CNC(=O)C1CCN(CC1)c1nc2c(csc2c(=O)(nH)1)c1cccc(c1)C
InChI=1SC27H28N4O3Sc11753720(1317)2216352423(22)2927(3026(24)33)3111919(101231)25(32)28151864821(1418)342h3813141619H91215H212H3(H2832)(H293033)
MFCD18789243
N((3methoxyphenyl)methyl)1(7(3methylphenyl)4oxo1Hthieno(32d)pyrimidin2yl)piperidine4carboxamide
N(3METHOXYBENZYL)1(4OXO7(MTOLYL)34DIHYDROTHIENO(32D)PYRIMIDIN2YL)PIPERIDINE4CARBOXAMIDE
N(3methoxybenzyl)1(7(3methylphenyl)4oxo34dihydrothieno(32d)pyrimidin2yl)piperidine4carboxamide
ZINC000049421377
ZINC49421377

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Available files

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