Vitas-M small molecule compound
5-acetyl-4-(4-chlorophenyl)-6-methyl-2-[(3-nitrobenzyl)sulfanyl]-1,4-dihydropyridine-3-carbonitrile
Catalog ID
STK757349
SMILES N#CC1=C(SCc2cccc(c2)[N+](=O)[O-])NC(=C(C1c1ccc(cc1)Cl)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 C22H18ClN3O3S MW 439.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18ClN3O3S/c1-13-20(14(2)27)21(16-6-8-17(23)9-7-16)19(11-24)22(25-13)30-12-15-4-3-5-18(10-15)26(28)29/h3-10,21,25H,12H2,1-2H3InChIKey
VCPQPOSHWUTINS-UHFFFAOYSA-NSynonyms
5ACETYL4(4CHLOROPHENYL)2((3NITROBENZYL)SULFANYL)6METHYL14DIHYDRO3PYRIDINECARBONITRILE
5acetyl4(4chlorophenyl)6methyl2((3nitrobenzyl)sulfanyl)14dihydropyridine3carbonitrile
5ACETYL4(4CHLOROPHENYL)6METHYL2((3NITROPHENYL)METHYLSULFANYL)14DIHYDROPYRIDINE3CARBONITRILE
CC1=C(C(C(=C(N1)SCC2=CC(=CC=C2)(N+)(=O)(O))C#N)C3=CC=C(C=C3)Cl)C(=O)C
InChI=1SC22H18ClN3O3Sc11320(14(2)27)21(166817(23)9716)19(1124)22(2513)30121543518(1015)26(28)29h3102125H12H212H3
MFCD01240881
N#CC1=C(SCc2cccc(c2)(N+)(=O)(O))NC(=C(C1c1ccc(cc1)Cl)C(=O)C)C
ZINC000000716242
ZINC000008439268
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