Vitas-M small molecule compound

propan-2-yl 5-carbamoyl-2-{[(4-ethylpiperazin-1-yl)acetyl]amino}-4-methylthiophene-3-carboxylate

Catalog ID
STK458781
SMILES CCN1CCN(CC1)CC(=O)Nc1sc(c(c1C(=O)OC(C)C)C)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 C18H28N4O4S MW 396.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H28N4O4S/c1-5-21-6-8-22(9-7-21)10-13(23)20-17-14(18(25)26-11(2)3)12(4)15(27-17)16(19)24/h11H,5-10H2,1-4H3,(H2,19,24)(H,20,23)
InChIKey
GPIBXZLUDOUVNN-UHFFFAOYSA-N
Synonyms

CCN1CCN(CC1)CC(=O)NC2=C(C(=C(S2)C(=O)N)C)C(=O)OC(C)C
InChI=1SC18H28N4O4Sc15216822(9721)1013(23)201714(18(25)2611(2)3)12(4)15(2717)16(19)24h11H510H214H3(H21924)(H2023)
METHYLETHYL5CARBAMOYL2(2(4ETHYLPIPERAZINYL)ACETYLAMINO)4METHYLTHIOPHENE3CARBOXYLATE
MFCD05071049
propan2yl5carbamoyl2(((4ethylpiperazin1yl)acetyl)amino)4methylthiophene3carboxylate
propan2yl5carbamoyl2((2(4ethylpiperazin1yl)acetyl)amino)4methylthiophene3carboxylate
ZINC000023095773
ZINC23095773

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Available files

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