Vitas-M small molecule compound
N-(2,3-dihydro-1H-inden-5-yl)-2-{[6-methyl-3-(3-methylbutyl)-4-oxo-4,5-dihydro-3H-pyrrolo[3,2-d]pyrimidin-2-yl]sulfanyl}acetamide
Catalog ID
STL093632
SMILES CC(CCn1c(SCC(=O)Nc2ccc3c(c2)CCC3)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 C23H28N4O2S MW 424.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H28N4O2S/c1-14(2)9-10-27-22(29)21-19(11-15(3)24-21)26-23(27)30-13-20(28)25-18-8-7-16-5-4-6-17(16)12-18/h7-8,11-12,14,24H,4-6,9-10,13H2,1-3H3,(H,25,28)InChIKey
ZRASLOXGPKLLSZ-UHFFFAOYSA-NSynonyms
CC(CCn1c(SCC(=O)Nc2ccc3c(c2)CCC3)nc2c(c1=O)(nH)c(c2)C)C
CC1=CC2=C(N1)C(=O)N(C(=N2)SCC(=O)NC3=CC4=C(CCC4)C=C3)CCC(C)C
InChI=1SC23H28N4O2Sc114(2)9102722(29)2119(1115(3)2421)2623(27)301320(28)2518871654617(16)1218h7811121424H4691013H213H3(H2528)
MFCD18787766
N(23dihydro1Hinden5yl)2((6methyl3(3methylbutyl)4oxo45dihydro3Hpyrrolo(32d)pyrimidin2yl)sulfanyl)acetamide
N(23dihydro1Hinden5yl)2((6methyl3(3methylbutyl)4oxo5Hpyrrolo(32d)pyrimidin2yl)sulfanyl)acetamide
ZINC000067238245
ZINC67238245
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