N-(2,5-diethoxyphenyl)-7-(5-methylthiophen-2-yl)-4,7-bis(oxidanylidene)heptanamide

Systemtic Name: N-(2,5-diethoxyphenyl)-7-(5-methylthiophen-2-yl)-4,7-bis(oxidanylidene)heptanamide Openeye Name: N-(2,5-diethoxyphenyl)-7-(5-methyl-2-thienyl)-4,7-dioxo-heptanamide CAS Name: N-(2,5-diethoxyphenyl)-7-(5-methyl-2-thiophenyl)-4,7-dioxoheptanamide IUPAC Name: N-(2,5-diethoxyphenyl)-7-(5-methylthiophen-2-yl)-4,7-dioxoheptanamide Traditional Name: N-(2,5-diethoxyphenyl)-4,7-diketo-7-(5-methyl-2-thienyl)enanthamide Formula: C22H27NO5S MolecularWeight: 417.51848

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1)OCC)NC(=O)CCC(=O)CCC(=O)C2=CC=C(S2)C

Isomeric SMILES

CCOC1=CC(=C(C=C1)OCC)NC(=O)CCC(=O)CCC(=O)C2=CC=C(S2)C

InChI

InChI=1S/C22H27NO5S/c1-4-27-17-9-11-20(28-5-2)18(14-17)23-22(26)13-8-16(24)7-10-19(25)21-12-6-15(3)29-21/h6,9,11-12,14H,4-5,7-8,10,13H2,1-3H3,(H,23,26)