Vitas-M small molecule compound
2-[(3-butyl-6-methyl-4-oxo-4,5-dihydro-3H-pyrrolo[3,2-d]pyrimidin-2-yl)sulfanyl]-N-[2-(3,4-dimethoxyphenyl)ethyl]acetamide
Catalog ID
STL093646
SMILES CCCCn1c(SCC(=O)NCCc2ccc(c(c2)OC)OC)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 C23H30N4O4S MW 458.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H30N4O4S/c1-5-6-11-27-22(29)21-17(12-15(2)25-21)26-23(27)32-14-20(28)24-10-9-16-7-8-18(30-3)19(13-16)31-4/h7-8,12-13,25H,5-6,9-11,14H2,1-4H3,(H,24,28)InChIKey
YJNCRGDTWOOEFK-UHFFFAOYSA-NSynonyms
2((3butyl6methyl4oxo45dihydro3Hpyrrolo(32d)pyrimidin2yl)sulfanyl)N(2(34dimethoxyphenyl)ethyl)acetamide
2((3butyl6methyl4oxo5Hpyrrolo(32d)pyrimidin2yl)sulfanyl)N(2(34dimethoxyphenyl)ethyl)acetamide
CCCCN1C(=O)C2=C(C=C(N2)C)N=C1SCC(=O)NCCC3=CC(=C(C=C3)OC)OC
CCCCn1c(SCC(=O)NCCc2ccc(c(c2)OC)OC)nc2c(c1=O)(nH)c(c2)C
InChI=1SC23H30N4O4Sc156112722(29)2117(1215(2)2521)2623(27)321420(28)24109167818(303)19(1316)314h78121325H5691114H214H3(H2428)
MFCD18787780
ZINC000067238301
ZINC67238301
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