Vitas-M small molecule compound
N-(2,3-dichlorophenyl)-2-[5-{[(4-oxo-3,4-dihydroquinazolin-2-yl)methyl]sulfanyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]acetamide
Catalog ID
STL122279
SMILES C=CCn1c(SCc2nc3ccccc3c(=O)[nH]2)nnc1CC(=O)Nc1cccc(c1Cl)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 C22H18Cl2N6O2S MW 501.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18Cl2N6O2S/c1-2-10-30-18(11-19(31)26-16-9-5-7-14(23)20(16)24)28-29-22(30)33-12-17-25-15-8-4-3-6-13(15)21(32)27-17/h2-9H,1,10-12H2,(H,26,31)(H,25,27,32)InChIKey
KHKABWRONUDDNP-UHFFFAOYSA-NSynonyms
C=CCN1C(=NN=C1SCC2=NC(=O)C3=CC=CC=C3N2)CC(=O)NC4=C(C(=CC=C4)Cl)Cl
C=CCn1c(SCc2nc3ccccc3c(=O)(nH)2)nnc1CC(=O)Nc1cccc(c1Cl)Cl
InChI=1SC22H18Cl2N6O2Sc12103018(1119(31)261695714(23)20(16)24)282922(30)3312172515843613(15)21(32)2717h29H11012H2(H2631)(H252732)
MFCD18435222
N(23dichlorophenyl)2(5(((4oxo34dihydroquinazolin2yl)methyl)sulfanyl)4(prop2en1yl)4H124triazol3yl)acetamide
N(23dichlorophenyl)2(5((4oxo1Hquinazolin2yl)methylsulfanyl)4prop2enyl124triazol3yl)acetamide
ZINC000067189961
ZINC67189961
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