Vitas-M small molecule compound
N-(3-cyanophenyl)-2-{[6-methyl-3-(2-methylpropyl)-4-oxo-4,5-dihydro-3H-pyrrolo[3,2-d]pyrimidin-2-yl]sulfanyl}acetamide
Catalog ID
STL093560
SMILES N#Cc1cccc(c1)NC(=O)CSc1nc2cc([nH]c2c(=O)n1CC(C)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 C20H21N5O2S MW 395.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N5O2S/c1-12(2)10-25-19(27)18-16(7-13(3)22-18)24-20(25)28-11-17(26)23-15-6-4-5-14(8-15)9-21/h4-8,12,22H,10-11H2,1-3H3,(H,23,26)InChIKey
ZGMZUIAKXLGDNY-UHFFFAOYSA-NSynonyms
CC1=CC2=C(N1)C(=O)N(C(=N2)SCC(=O)NC3=CC=CC(=C3)C#N)CC(C)C
InChI=1SC20H21N5O2Sc112(2)102519(27)1816(713(3)2218)2420(25)281117(26)231564514(815)921h481222H1011H213H3(H2326)
MFCD18787694
N#Cc1cccc(c1)NC(=O)CSc1nc2cc((nH)c2c(=O)n1CC(C)C)C
N(3cyanophenyl)2((6methyl3(2methylpropyl)4oxo45dihydro3Hpyrrolo(32d)pyrimidin2yl)sulfanyl)acetamide
N(3cyanophenyl)2((6methyl3(2methylpropyl)4oxo5Hpyrrolo(32d)pyrimidin2yl)sulfanyl)acetamide
ZINC000067237849
ZINC67237849
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