2-methyl-1-oxidanylidene-N-(4-phenoxyphenyl)-3-thiophen-2-yl-3,4-dihydroisoquinoline-4-carboxamide

Systemtic Name: 2-methyl-1-oxidanylidene-N-(4-phenoxyphenyl)-3-thiophen-2-yl-3,4-dihydroisoquinoline-4-carboxamide Openeye Name: 2-methyl-1-oxo-N-(4-phenoxyphenyl)-3-(2-thienyl)-3,4-dihydroisoquinoline-4-carboxamide CAS Name: 2-methyl-1-oxo-N-(4-phenoxyphenyl)-3-thiophen-2-yl-3,4-dihydroisoquinoline-4-carboxamide IUPAC Name: 2-methyl-1-oxo-N-(4-phenoxyphenyl)-3-thiophen-2-yl-3,4-dihydroisoquinoline-4-carboxamide Traditional Name: 1-keto-2-methyl-N-(4-phenoxyphenyl)-3-(2-thienyl)-3,4-dihydroisoquinoline-4-carboxamide Formula: C27H22N2O3S MolecularWeight: 454.54018

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(C(C2=CC=CC=C2C1=O)C(=O)NC3=CC=C(C=C3)OC4=CC=CC=C4)C5=CC=CS5

Isomeric SMILES

CN1C(C(C2=CC=CC=C2C1=O)C(=O)NC3=CC=C(C=C3)OC4=CC=CC=C4)C5=CC=CS5

InChI

InChI=1S/C27H22N2O3S/c1-29-25(23-12-7-17-33-23)24(21-10-5-6-11-22(21)27(29)31)26(30)28-18-13-15-20(16-14-18)32-19-8-3-2-4-9-19/h2-17,24-25H,1H3,(H,28,30)