Vitas-M small molecule compound
N-[4-(dimethylamino)phenyl]-2-{[6-methyl-3-(3-methylbutyl)-4-oxo-4,5-dihydro-3H-pyrrolo[3,2-d]pyrimidin-2-yl]sulfanyl}acetamide
Catalog ID
STL093575
SMILES CC(CCn1c(SCC(=O)Nc2ccc(cc2)N(C)C)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 C22H29N5O2S MW 427.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H29N5O2S/c1-14(2)10-11-27-21(29)20-18(12-15(3)23-20)25-22(27)30-13-19(28)24-16-6-8-17(9-7-16)26(4)5/h6-9,12,14,23H,10-11,13H2,1-5H3,(H,24,28)InChIKey
UOUZFDDYGONVBK-UHFFFAOYSA-NSynonyms
CC(CCn1c(SCC(=O)Nc2ccc(cc2)N(C)C)nc2c(c1=O)(nH)c(c2)C)C
CC1=CC2=C(N1)C(=O)N(C(=N2)SCC(=O)NC3=CC=C(C=C3)N(C)C)CCC(C)C
InChI=1SC22H29N5O2Sc114(2)10112721(29)2018(1215(3)2320)2522(27)301319(28)24166817(9716)26(4)5h69121423H101113H215H3(H2428)
MFCD18787709
N(4(dimethylamino)phenyl)2((6methyl3(3methylbutyl)4oxo45dihydro3Hpyrrolo(32d)pyrimidin2yl)sulfanyl)acetamide
N(4(dimethylamino)phenyl)2((6methyl3(3methylbutyl)4oxo5Hpyrrolo(32d)pyrimidin2yl)sulfanyl)acetamide
ZINC000067237915
ZINC67237915
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