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

Systemtic Name: 1-azanyl-N-(3-ethoxyphenyl)-5-phenethyl-6,7,8,9-tetrahydrothieno[2,3-c]isoquinoline-2-carboxamide Openeye Name: 1-amino-N-(3-ethoxyphenyl)-5-phenethyl-6,7,8,9-tetrahydrothieno[2,3-c]isoquinoline-2-carboxamide CAS Name: 1-amino-N-(3-ethoxyphenyl)-5-phenethyl-6,7,8,9-tetrahydrothieno[2,3-c]isoquinoline-2-carboxamide IUPAC Name: 1-amino-N-(3-ethoxyphenyl)-5-phenethyl-6,7,8,9-tetrahydrothieno[2,3-c]isoquinoline-2-carboxamide Traditional Name: 1-amino-N-m-phenetyl-5-phenethyl-6,7,8,9-tetrahydrothien[2,3-c]isoquinoline-2-carboxamide Formula: C28H29N3O2S MolecularWeight: 471.61376

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)NC(=O)C2=C(C3=C4CCCCC4=C(N=C3S2)CCC5=CC=CC=C5)N

Isomeric SMILES

CCOC1=CC=CC(=C1)NC(=O)C2=C(C3=C4CCCCC4=C(N=C3S2)CCC5=CC=CC=C5)N

InChI

InChI=1S/C28H29N3O2S/c1-2-33-20-12-8-11-19(17-20)30-27(32)26-25(29)24-22-14-7-6-13-21(22)23(31-28(24)34-26)16-15-18-9-4-3-5-10-18/h3-5,8-12,17H,2,6-7,13-16,29H2,1H3,(H,30,32)