Vitas-M small molecule compound
methyl 2-({N-(4-methoxyphenyl)-N-[(4-methylphenyl)sulfonyl]glycyl}amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Catalog ID
STK885432
SMILES COc1ccc(cc1)N(S(=O)(=O)c1ccc(cc1)C)CC(=O)Nc1sc2c(c1C(=O)OC)CCCC2
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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 C26H28N2O6S2 MW 528.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H28N2O6S2/c1-17-8-14-20(15-9-17)36(31,32)28(18-10-12-19(33-2)13-11-18)16-23(29)27-25-24(26(30)34-3)21-6-4-5-7-22(21)35-25/h8-15H,4-7,16H2,1-3H3,(H,27,29)InChIKey
JVNFWMYKQGAAON-UHFFFAOYSA-NSynonyms
CC1=CC=C(C=C1)S(=O)(=O)N(CC(=O)NC2=C(C3=C(S2)CCCC3)C(=O)OC)C4=CC=C(C=C4)OC
InChI=1SC26H28N2O6S2c11781420(15917)36(3132)28(18101219(332)131118)1623(29)272524(26(30)343)21645722(21)3525h815H4716H213H3(H2729)
methyl2((2(4methoxyN(4methylphenyl)sulfonylanilino)acetyl)amino)4567tetrahydro1benzothiophene3carboxylate
methyl2((N(4methoxyphenyl)N((4methylphenyl)sulfonyl)glycyl)amino)4567tetrahydro1benzothiophene3carboxylate
MFCD04089108
ZINC000000982888
ZINC00982888
ZINC982888
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