methyl 2-[(4-ethanoylpiperazin-1-yl)carbonylamino]-5,5-dimethyl-4,7-dihydrothieno[2,3-c]pyran-3-carboxylate

Systemtic Name: methyl 2-[(4-ethanoylpiperazin-1-yl)carbonylamino]-5,5-dimethyl-4,7-dihydrothieno[2,3-c]pyran-3-carboxylate Openeye Name: methyl 2-[(4-acetylpiperazine-1-carbonyl)amino]-5,5-dimethyl-4,7-dihydrothieno[2,3-c]pyran-3-carboxylate CAS Name: 2-[[(4-acetyl-1-piperazinyl)-oxomethyl]amino]-5,5-dimethyl-4,7-dihydrothieno[2,3-c]pyran-3-carboxylic acid methyl ester IUPAC Name: methyl 2-[(4-acetylpiperazine-1-carbonyl)amino]-5,5-dimethyl-4,7-dihydrothieno[2,3-c]pyran-3-carboxylate Traditional Name: 2-[(4-acetylpiperazine-1-carbonyl)amino]-5,5-dimethyl-4,7-dihydrothieno[2,3-c]pyran-3-carboxylic acid methyl ester Formula: C18H25N3O5S MolecularWeight: 395.4732

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C(=O)NC2=C(C3=C(S2)COC(C3)(C)C)C(=O)OC

Isomeric SMILES

CC(=O)N1CCN(CC1)C(=O)NC2=C(C3=C(S2)COC(C3)(C)C)C(=O)OC

InChI

InChI=1S/C18H25N3O5S/c1-11(22)20-5-7-21(8-6-20)17(24)19-15-14(16(23)25-4)12-9-18(2,3)26-10-13(12)27-15/h5-10H2,1-4H3,(H,19,24)