Vitas-M small molecule compound

methyl 2-({[2-(cyclopropylcarbonyl)hydrazinyl]carbonothioyl}amino)-5-(dimethylcarbamoyl)-4-methylthiophene-3-carboxylate

Catalog ID
STK441939
SMILES COC(=O)c1c(NC(=S)NNC(=O)C2CC2)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 C15H20N4O4S2 MW 384.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H20N4O4S2/c1-7-9(14(22)23-4)12(25-10(7)13(21)19(2)3)16-15(24)18-17-11(20)8-5-6-8/h8H,5-6H2,1-4H3,(H,17,20)(H2,16,18,24)
InChIKey
ZMFHKOCIRDMOAK-UHFFFAOYSA-N
Synonyms

CC1=C(SC(=C1C(=O)OC)NC(=S)NNC(=O)C2CC2)C(=O)N(C)C
InChI=1SC15H20N4O4S2c179(14(22)234)12(2510(7)13(21)19(2)3)1615(24)181711(20)8568h8H56H214H3(H1720)(H2161824)
methyl2(((2(cyclopropylcarbonyl)hydrazinyl)carbonothioyl)amino)5(dimethylcarbamoyl)4methylthiophene3carboxylate
methyl2((cyclopropanecarbonylamino)carbamothioylamino)5(dimethylcarbamoyl)4methylthiophene3carboxylate
METHYL5(NNDIMETHYLCARBAMOYL)2((((CYCLOPROPYLCARBONYLAMINO)AMINO)THIOXOMETHYL)AMINO)4METHYLTHIOPHENE3CARBOXYLATE
MFCD03900579
ZINC000017078514
ZINC17078514

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.