ethyl 6-methyl-2-[2-(4-methyl-2-oxidanylidene-chromen-7-yl)oxypropanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Systemtic Name: ethyl 6-methyl-2-[2-(4-methyl-2-oxidanylidene-chromen-7-yl)oxypropanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: ethyl 6-methyl-2-[2-(4-methyl-2-oxo-chromen-7-yl)oxypropanoylamino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: 6-methyl-2-[[2-[(4-methyl-2-oxo-1-benzopyran-7-yl)oxy]-1-oxopropyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl 6-methyl-2-[2-(4-methyl-2-oxochromen-7-yl)oxypropanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: 2-[2-(2-keto-4-methyl-chromen-7-yl)oxypropanoylamino]-6-methyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid ethyl ester Formula: C25H27NO6S MolecularWeight: 469.54998

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=C1CCC(C2)C)NC(=O)C(C)OC3=CC4=C(C=C3)C(=CC(=O)O4)C

Isomeric SMILES

CCOC(=O)C1=C(SC2=C1CCC(C2)C)NC(=O)C(C)OC3=CC4=C(C=C3)C(=CC(=O)O4)C

InChI

InChI=1S/C25H27NO6S/c1-5-30-25(29)22-18-8-6-13(2)10-20(18)33-24(22)26-23(28)15(4)31-16-7-9-17-14(3)11-21(27)32-19(17)12-16/h7,9,11-13,15H,5-6,8,10H2,1-4H3,(H,26,28)