Vitas-M small molecule compound
N-(4-chlorophenyl)-5-(8-methoxy-4-oxo-2-thioxo-1,2,4,5-tetrahydro-3H-pyrimido[5,4-b]indol-3-yl)pentanamide
Catalog ID
STL131714
SMILES COc1ccc2c(c1)c1[nH]c(=S)n(c(=O)c1[nH]2)CCCCC(=O)Nc1ccc(cc1)Cl
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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 C22H21ClN4O3S MW 456.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21ClN4O3S/c1-30-15-9-10-17-16(12-15)19-20(25-17)21(29)27(22(31)26-19)11-3-2-4-18(28)24-14-7-5-13(23)6-8-14/h5-10,12,25H,2-4,11H2,1H3,(H,24,28)(H,26,31)InChIKey
FVPICHKXZIPKGD-UHFFFAOYSA-NSynonyms
COC1=CC2=C(C=C1)NC3=C2NC(=S)N(C3=O)CCCCC(=O)NC4=CC=C(C=C4)Cl
COc1ccc2c(c1)c1(nH)c(=S)n(c(=O)c1(nH)2)CCCCC(=O)Nc1ccc(cc1)Cl
InChI=1SC22H21ClN4O3Sc130159101716(1215)1920(2517)21(29)27(22(31)2619)1132418(28)24147513(23)6814h5101225H2411H21H3(H2428)(H2631)
MFCD14781001
N(4chlorophenyl)5(8methoxy4oxo2sulfanylidene15dihydropyrimido(54b)indol3yl)pentanamide
N(4chlorophenyl)5(8methoxy4oxo2thioxo1245tetrahydro3Hpyrimido(54b)indol3yl)pentanamide
ZINC000020331254
ZINC20331254
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