ethyl 1-(ethoxymethylideneamino)-5-phenyl-6,7,8,9-tetrahydrothieno[2,3-c]isoquinoline-2-carboxylate

Systemtic Name: ethyl 1-(ethoxymethylideneamino)-5-phenyl-6,7,8,9-tetrahydrothieno[2,3-c]isoquinoline-2-carboxylate Openeye Name: ethyl 1-(ethoxymethyleneamino)-5-phenyl-6,7,8,9-tetrahydrothieno[2,3-c]isoquinoline-2-carboxylate CAS Name: 1-(ethoxymethylideneamino)-5-phenyl-6,7,8,9-tetrahydrothieno[2,3-c]isoquinoline-2-carboxylic acid ethyl ester IUPAC Name: ethyl 1-(ethoxymethylideneamino)-5-phenyl-6,7,8,9-tetrahydrothieno[2,3-c]isoquinoline-2-carboxylate Traditional Name: 1-(ethoxymethyleneamino)-5-phenyl-6,7,8,9-tetrahydrothien[2,3-c]isoquinoline-2-carboxylic acid ethyl ester Formula: C23H24N2O3S MolecularWeight: 408.51326

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Descriptors Computed from Structure

Canonical SMILES:

CCOC=NC1=C(SC2=NC(=C3CCCCC3=C12)C4=CC=CC=C4)C(=O)OCC

Isomeric SMILES

CCOC=NC1=C(SC2=NC(=C3CCCCC3=C12)C4=CC=CC=C4)C(=O)OCC

InChI

InChI=1S/C23H24N2O3S/c1-3-27-14-24-20-18-16-12-8-9-13-17(16)19(15-10-6-5-7-11-15)25-22(18)29-21(20)23(26)28-4-2/h5-7,10-11,14H,3-4,8-9,12-13H2,1-2H3