Vitas-M small molecule compound
N-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-2-({[3-(3-methylphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]methyl}sulfanyl)acetamide
Catalog ID
STK226808
SMILES O=C(Nc1c(C)n(n(c1=O)c1ccccc1)C)CSCc1nc2ccccc2c(=O)n1c1cccc(c1)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 C29H27N5O3S MW 525.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H27N5O3S/c1-19-10-9-13-22(16-19)33-25(30-24-15-8-7-14-23(24)28(33)36)17-38-18-26(35)31-27-20(2)32(3)34(29(27)37)21-11-5-4-6-12-21/h4-16H,17-18H2,1-3H3,(H,31,35)InChIKey
ILLBNLQZXOGPQZ-UHFFFAOYSA-NSynonyms
CC1=CC(=CC=C1)N2C(=NC3=CC=CC=C3C2=O)CSCC(=O)NC4=C(N(N(C4=O)C5=CC=CC=C5)C)C
InChI=1SC29H27N5O3Sc1191091322(1619)3325(302415871423(24)28(33)36)17381826(35)312720(2)32(3)34(29(27)37)21115461221h416H1718H213H3(H3135)
MFCD06090949
N(15dimethyl3oxo2phenyl23dihydro1Hpyrazol4yl)2(((3(3methylphenyl)4oxo34dihydroquinazolin2yl)methyl)sulfanyl)acetamide
N(15dimethyl3oxo2phenylpyrazol4yl)2((3(3methylphenyl)4oxoquinazolin2yl)methylsulfanyl)acetamide
ZINC000016349901
ZINC16349901
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