Vitas-M small molecule compound
5-acetyl-6-methyl-4-(2-methylphenyl)-2-[(2-nitrobenzyl)sulfanyl]-1,4-dihydropyridine-3-carbonitrile
Catalog ID
STK957286
SMILES N#CC1=C(SCc2ccccc2[N+](=O)[O-])NC(=C(C1c1ccccc1C)C(=O)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 C23H21N3O3S MW 419.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21N3O3S/c1-14-8-4-6-10-18(14)22-19(12-24)23(25-15(2)21(22)16(3)27)30-13-17-9-5-7-11-20(17)26(28)29/h4-11,22,25H,13H2,1-3H3InChIKey
OBHQTRBJHNQIFH-UHFFFAOYSA-NSynonyms
362482-54-0362482540
5ACETYL2((2NITROBENZYL)SULFANYL)6METHYL4(2METHYLPHENYL)14DIHYDRO3PYRIDINECARBONITRILE
5acetyl6methyl4(2methylphenyl)2((2nitrobenzyl)sulfanyl)14dihydropyridine3carbonitrile
5ACETYL6METHYL4(2METHYLPHENYL)2((2NITROPHENYL)METHYLSULFANYL)14DIHYDROPYRIDINE3CARBONITRILE
CC1=CC=CC=C1C2C(=C(NC(=C2C(=O)C)C)SCC3=CC=CC=C3(N+)(=O)(O))C#N
InChI=1SC23H21N3O3Sc1148461018(14)2219(1224)23(2515(2)21(22)16(3)27)3013179571120(17)26(28)29h4112225H13H213H3
MFCD01451798
N#CC1=C(SCc2ccccc2(N+)(=O)(O))NC(=C(C1c1ccccc1C)C(=O)C)C
ZINC000000996001
ZINC000000996002
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