Vitas-M small molecule compound
methyl 2-[({4-[(3,6-dichloro-1-benzothiophen-2-yl)carbonyl]piperazin-1-yl}carbonothioyl)amino]-5-(dimethylcarbamoyl)-4-methylthiophene-3-carboxylate
Catalog ID
STK455106
SMILES COC(=O)c1c(NC(=S)N2CCN(CC2)C(=O)c2sc3c(c2Cl)ccc(c3)Cl)sc(c1C)C(=O)N(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 C24H24Cl2N4O4S3 MW 599.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H24Cl2N4O4S3/c1-12-16(23(33)34-4)20(37-18(12)21(31)28(2)3)27-24(35)30-9-7-29(8-10-30)22(32)19-17(26)14-6-5-13(25)11-15(14)36-19/h5-6,11H,7-10H2,1-4H3,(H,27,35)InChIKey
VLRUIQYJGCYHRX-UHFFFAOYSA-NSynonyms
CC1=C(SC(=C1C(=O)OC)NC(=S)N2CCN(CC2)C(=O)C3=C(C4=C(S3)C=C(C=C4)Cl)Cl)C(=O)N(C)C
InChI=1SC24H24Cl2N4O4S3c11216(23(33)344)20(3718(12)21(31)28(2)3)2724(35)309729(81030)22(32)1917(26)146513(25)1115(14)3619h5611H710H214H3(H2735)
methyl2(((4((36dichloro1benzothiophen2yl)carbonyl)piperazin1yl)carbonothioyl)amino)5(dimethylcarbamoyl)4methylthiophene3carboxylate
METHYL2(((4((36DICHLOROBENZO(B)THIOPHEN2YL)CARBONYL)PIPERAZINYL)THIOXOMETHYL)AMINO)5(NNDIMETHYLCARBAMOYL)4METHYLTHIOPHENE3CARBOXYLATE
METHYL2((4(36DICHLORO1BENZOTHIOPHENE2CARBONYL)PIPERAZINE1CARBOTHIOYL)AMINO)5(DIMETHYLCARBAMOYL)4METHYLTHIOPHENE3CARBOXYLATE
MFCD04228348
ZINC000059749739
ZINC59749739
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.