Vitas-M small molecule compound
methyl 5-carbamoyl-2-[({[5-(furan-2-yl)-4-(tetrahydrofuran-2-ylmethyl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]-4-methylthiophene-3-carboxylate
Catalog ID
STK467602
SMILES COC(=O)c1c(NC(=O)CSc2nnc(n2CC2CCCO2)c2ccco2)sc(c1C)C(=O)N
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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 C21H23N5O6S2 MW 505.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H23N5O6S2/c1-11-15(20(29)30-2)19(34-16(11)17(22)28)23-14(27)10-33-21-25-24-18(13-6-4-8-32-13)26(21)9-12-5-3-7-31-12/h4,6,8,12H,3,5,7,9-10H2,1-2H3,(H2,22,28)(H,23,27)InChIKey
XZMRCVZKMVTPOG-UHFFFAOYSA-NSynonyms
CC1=C(SC(=C1C(=O)OC)NC(=O)CSC2=NN=C(N2CC3CCCO3)C4=CC=CO4)C(=O)N
InChI=1SC21H23N5O6S2c11115(20(29)302)19(3416(11)17(22)28)2314(27)103321252418(136483213)26(21)9125373112h46812H357910H212H3(H22228)(H2327)
methyl5carbamoyl2((((5(furan2yl)4(tetrahydrofuran2ylmethyl)4H124triazol3yl)sulfanyl)acetyl)amino)4methylthiophene3carboxylate
methyl5carbamoyl2((2((5(furan2yl)4(oxolan2ylmethyl)124triazol3yl)sulfanyl)acetyl)amino)4methylthiophene3carboxylate
METHYL5CARBAMOYL2(2(5(2FURYL)4(OXOLAN2YLMETHYL)(124TRIAZOL3YLTHIO))ACETYLAMINO)4METHYLTHIOPHENE3CARBOXYLATE
MFCD06033297
ZINC000020295052
ZINC000020295056
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