methyl 5,5-dimethyl-2-[[2-(3-methylbutylamino)-2-oxidanylidene-ethanoyl]amino]-4,7-dihydrothieno[2,3-c]pyran-3-carboxylate

Systemtic Name: methyl 5,5-dimethyl-2-[[2-(3-methylbutylamino)-2-oxidanylidene-ethanoyl]amino]-4,7-dihydrothieno[2,3-c]pyran-3-carboxylate Openeye Name: methyl 2-[[2-(isopentylamino)-2-oxo-acetyl]amino]-5,5-dimethyl-4,7-dihydrothieno[2,3-c]pyran-3-carboxylate CAS Name: 5,5-dimethyl-2-[[2-(3-methylbutylamino)-1,2-dioxoethyl]amino]-4,7-dihydrothieno[2,3-c]pyran-3-carboxylic acid methyl ester IUPAC Name: methyl 5,5-dimethyl-2-[[2-(3-methylbutylamino)-2-oxoacetyl]amino]-4,7-dihydrothieno[2,3-c]pyran-3-carboxylate Traditional Name: 2-[[2-(isoamylamino)-2-keto-acetyl]amino]-5,5-dimethyl-4,7-dihydrothieno[2,3-c]pyran-3-carboxylic acid methyl ester Formula: C18H26N2O5S MolecularWeight: 382.47444

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)C(=O)NC1=C(C2=C(S1)COC(C2)(C)C)C(=O)OC

Isomeric SMILES

CC(C)CCNC(=O)C(=O)NC1=C(C2=C(S1)COC(C2)(C)C)C(=O)OC

InChI

InChI=1S/C18H26N2O5S/c1-10(2)6-7-19-14(21)15(22)20-16-13(17(23)24-5)11-8-18(3,4)25-9-12(11)26-16/h10H,6-9H2,1-5H3,(H,19,21)(H,20,22)