Vitas-M small molecule compound
2-{[2-(4-benzylpiperazin-1-yl)-2-oxoethyl]sulfanyl}-6-methyl-3-(3-methylbutyl)-3,5-dihydro-4H-pyrrolo[3,2-d]pyrimidin-4-one
Catalog ID
STL093619
SMILES CC(CCn1c(SCC(=O)N2CCN(CC2)Cc2ccccc2)nc2c(c1=O)[nH]c(c2)C)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 C25H33N5O2S MW 467.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H33N5O2S/c1-18(2)9-10-30-24(32)23-21(15-19(3)26-23)27-25(30)33-17-22(31)29-13-11-28(12-14-29)16-20-7-5-4-6-8-20/h4-8,15,18,26H,9-14,16-17H2,1-3H3InChIKey
AHHARXGPIMEPKX-UHFFFAOYSA-NSynonyms
2((2(4benzylpiperazin1yl)2oxoethyl)sulfanyl)6methyl3(3methylbutyl)35dihydro4Hpyrrolo(32d)pyrimidin4one
2(2(4benzylpiperazin1yl)2oxoethyl)sulfanyl6methyl3(3methylbutyl)5Hpyrrolo(32d)pyrimidin4one
CC(CCn1c(SCC(=O)N2CCN(CC2)Cc2ccccc2)nc2c(c1=O)(nH)c(c2)C)C
CC1=CC2=C(N1)C(=O)N(C(=N2)SCC(=O)N3CCN(CC3)CC4=CC=CC=C4)CCC(C)C
InChI=1SC25H33N5O2Sc118(2)9103024(32)2321(1519(3)2623)2725(30)331722(31)29131128(121429)16207546820h48151826H9141617H213H3
MFCD18787753
ZINC000067238189
ZINC67238189
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