1-azanyl-N-(4-methoxyphenyl)-5-phenethyl-6,7,8,9-tetrahydrothieno[2,3-c]isoquinoline-2-carboxamide

Systemtic Name: 1-azanyl-N-(4-methoxyphenyl)-5-phenethyl-6,7,8,9-tetrahydrothieno[2,3-c]isoquinoline-2-carboxamide Openeye Name: 1-amino-N-(4-methoxyphenyl)-5-phenethyl-6,7,8,9-tetrahydrothieno[2,3-c]isoquinoline-2-carboxamide CAS Name: 1-amino-N-(4-methoxyphenyl)-5-phenethyl-6,7,8,9-tetrahydrothieno[2,3-c]isoquinoline-2-carboxamide IUPAC Name: 1-amino-N-(4-methoxyphenyl)-5-phenethyl-6,7,8,9-tetrahydrothieno[2,3-c]isoquinoline-2-carboxamide Traditional Name: 1-amino-N-(4-methoxyphenyl)-5-phenethyl-6,7,8,9-tetrahydrothien[2,3-c]isoquinoline-2-carboxamide Formula: C27H27N3O2S MolecularWeight: 457.58718

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)C2=C(C3=C4CCCCC4=C(N=C3S2)CCC5=CC=CC=C5)N

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)C2=C(C3=C4CCCCC4=C(N=C3S2)CCC5=CC=CC=C5)N

InChI

InChI=1S/C27H27N3O2S/c1-32-19-14-12-18(13-15-19)29-26(31)25-24(28)23-21-10-6-5-9-20(21)22(30-27(23)33-25)16-11-17-7-3-2-4-8-17/h2-4,7-8,12-15H,5-6,9-11,16,28H2,1H3,(H,29,31)