Vitas-M small molecule compound

N-benzyl-2-[(3-butyl-6-methyl-4-oxo-4,5-dihydro-3H-pyrrolo[3,2-d]pyrimidin-2-yl)sulfanyl]-N-ethylacetamide

Catalog ID
STL093669
SMILES CCCCn1c(SCC(=O)N(Cc2ccccc2)CC)nc2c(c1=O)[nH]c(c2)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 C22H28N4O2S MW 412.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H28N4O2S/c1-4-6-12-26-21(28)20-18(13-16(3)23-20)24-22(26)29-15-19(27)25(5-2)14-17-10-8-7-9-11-17/h7-11,13,23H,4-6,12,14-15H2,1-3H3
InChIKey
RTOYEODMXZVEBO-UHFFFAOYSA-N
Synonyms

CCCCN1C(=O)C2=C(C=C(N2)C)N=C1SCC(=O)N(CC)CC3=CC=CC=C3
CCCCn1c(SCC(=O)N(Cc2ccccc2)CC)nc2c(c1=O)(nH)c(c2)C
InChI=1SC22H28N4O2Sc146122621(28)2018(1316(3)2320)2422(26)291519(27)25(52)1417108791117h7111323H46121415H213H3
MFCD18787803
Nbenzyl2((3butyl6methyl4oxo45dihydro3Hpyrrolo(32d)pyrimidin2yl)sulfanyl)Nethylacetamide
Nbenzyl2((3butyl6methyl4oxo5Hpyrrolo(32d)pyrimidin2yl)sulfanyl)Nethylacetamide
ZINC000067238371
ZINC67238371

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Available files

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