Vitas-M small molecule compound
methyl 5-(dimethylcarbamoyl)-2-[({[5-(2-methoxyphenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]-4-methylthiophene-3-carboxylate
Catalog ID
STK467487
SMILES C=CCn1c(SCC(=O)Nc2sc(c(c2C(=O)OC)C)C(=O)N(C)C)nnc1c1ccccc1OC
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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 C24H27N5O5S2 MW 529.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H27N5O5S2/c1-7-12-29-20(15-10-8-9-11-16(15)33-5)26-27-24(29)35-13-17(30)25-21-18(23(32)34-6)14(2)19(36-21)22(31)28(3)4/h7-11H,1,12-13H2,2-6H3,(H,25,30)InChIKey
SODDDTVVYWMENI-UHFFFAOYSA-NSynonyms
CC1=C(SC(=C1C(=O)OC)NC(=O)CSC2=NN=C(N2CC=C)C3=CC=CC=C3OC)C(=O)N(C)C
InChI=1SC24H27N5O5S2c17122920(1510891116(15)335)262724(29)351317(30)252118(23(32)346)14(2)19(3621)22(31)28(3)4h711H11213H226H3(H2530)
methyl5(dimethylcarbamoyl)2((((5(2methoxyphenyl)4(prop2en1yl)4H124triazol3yl)sulfanyl)acetyl)amino)4methylthiophene3carboxylate
methyl5(dimethylcarbamoyl)2((2((5(2methoxyphenyl)4prop2enyl124triazol3yl)sulfanyl)acetyl)amino)4methylthiophene3carboxylate
MFCD07056885
ZINC000097945508
ZINC97945508
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