methyl 2-[(3-oxidanylidene-3-phenacyloxy-propyl)amino]-6-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Systemtic Name: methyl 2-[(3-oxidanylidene-3-phenacyloxy-propyl)amino]-6-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: methyl 2-[(3-oxo-3-phenacyloxy-propyl)amino]-6-phenyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: 2-[(3-oxo-3-phenacyloxypropyl)amino]-6-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid methyl ester IUPAC Name: methyl 2-[(3-oxo-3-phenacyloxypropyl)amino]-6-phenyl-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: 2-[(3-keto-3-phenacyloxy-propyl)amino]-6-phenyl-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid methyl ester Formula: C27H27NO5S MolecularWeight: 477.57198

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC2=C1CCC(C2)C3=CC=CC=C3)NCCC(=O)OCC(=O)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=C(SC2=C1CCC(C2)C3=CC=CC=C3)NCCC(=O)OCC(=O)C4=CC=CC=C4

InChI

InChI=1S/C27H27NO5S/c1-32-27(31)25-21-13-12-20(18-8-4-2-5-9-18)16-23(21)34-26(25)28-15-14-24(30)33-17-22(29)19-10-6-3-7-11-19/h2-11,20,28H,12-17H2,1H3