Vitas-M small molecule compound

methyl 2-{[(5-carbamoyl-1-ethyl-1H-pyrazol-4-yl)carbamothioyl]amino}-5-(diethylcarbamoyl)-4-methylthiophene-3-carboxylate

Catalog ID
STK457524
SMILES CCN(C(=O)c1sc(c(c1C)C(=O)OC)NC(=S)Nc1cnn(c1C(=O)N)CC)CC

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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 C19H26N6O4S2 MW 466.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H26N6O4S2/c1-6-24(7-2)17(27)14-10(4)12(18(28)29-5)16(31-14)23-19(30)22-11-9-21-25(8-3)13(11)15(20)26/h9H,6-8H2,1-5H3,(H2,20,26)(H2,22,23,30)
InChIKey
VZJSPLPVDILESY-UHFFFAOYSA-N
Synonyms

CCN1C(=C(C=N1)NC(=S)NC2=C(C(=C(S2)C(=O)N(CC)CC)C)C(=O)OC)C(=O)N
InChI=1SC19H26N6O4S2c1624(72)17(27)1410(4)12(18(28)295)16(3114)2319(30)221192125(83)13(11)15(20)26h9H68H215H3(H22026)(H2222330)
methyl2(((5carbamoyl1ethyl1Hpyrazol4yl)carbamothioyl)amino)5(diethylcarbamoyl)4methylthiophene3carboxylate
METHYL2((5CARBAMOYL1ETHYLPYRAZOL4YL)CARBAMOTHIOYLAMINO)5(DIETHYLCARBAMOYL)4METHYLTHIOPHENE3CARBOXYLATE
METHYL5(NNDIETHYLCARBAMOYL)2((((5CARBAMOYL1ETHYLPYRAZOL4YL)AMINO)THIOXOMETHYL)AMINO)4METHYLTHIOPHENE3CARBOXYLATE
MFCD05118524
ZINC000002859140
ZINC02859140
ZINC2859140

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Available files

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