ethyl (6R)-6-methyl-2-[3-(5-phenylfuran-2-yl)propanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Systemtic Name: ethyl (6R)-6-methyl-2-[3-(5-phenylfuran-2-yl)propanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: ethyl (6R)-6-methyl-2-[3-(5-phenyl-2-furyl)propanoylamino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: (6R)-6-methyl-2-[[1-oxo-3-(5-phenyl-2-furanyl)propyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl (6R)-6-methyl-2-[3-(5-phenylfuran-2-yl)propanoylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: (6R)-6-methyl-2-[3-(5-phenyl-2-furyl)propanoylamino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid ethyl ester Formula: C25H27NO4S MolecularWeight: 437.55118

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=C1CCC(C2)C)NC(=O)CCC3=CC=C(O3)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(SC2=C1CC[C@H](C2)C)NC(=O)CCC3=CC=C(O3)C4=CC=CC=C4

InChI

InChI=1S/C25H27NO4S/c1-3-29-25(28)23-19-12-9-16(2)15-21(19)31-24(23)26-22(27)14-11-18-10-13-20(30-18)17-7-5-4-6-8-17/h4-8,10,13,16H,3,9,11-12,14-15H2,1-2H3,(H,26,27)/t16-/m1/s1