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

Systemtic Name: methyl 5,5-dimethyl-2-[[4-(2-methylpropanoyl)piperazin-1-yl]carbonylamino]-4,7-dihydrothieno[2,3-c]pyran-3-carboxylate Openeye Name: methyl 5,5-dimethyl-2-[[4-(2-methylpropanoyl)piperazine-1-carbonyl]amino]-4,7-dihydrothieno[2,3-c]pyran-3-carboxylate CAS Name: 5,5-dimethyl-2-[[[4-(2-methyl-1-oxopropyl)-1-piperazinyl]-oxomethyl]amino]-4,7-dihydrothieno[2,3-c]pyran-3-carboxylic acid methyl ester IUPAC Name: methyl 5,5-dimethyl-2-[[4-(2-methylpropanoyl)piperazine-1-carbonyl]amino]-4,7-dihydrothieno[2,3-c]pyran-3-carboxylate Traditional Name: 2-[(4-isobutyrylpiperazine-1-carbonyl)amino]-5,5-dimethyl-4,7-dihydrothieno[2,3-c]pyran-3-carboxylic acid methyl ester Formula: C20H29N3O5S MolecularWeight: 423.52636

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H29N3O5S/c1-12(2)17(24)22-6-8-23(9-7-22)19(26)21-16-15(18(25)27-5)13-10-20(3,4)28-11-14(13)29-16/h12H,6-11H2,1-5H3,(H,21,26)