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

Systemtic Name: 1-azanyl-N-(4-bromophenyl)-5-phenethyl-6,7,8,9-tetrahydrothieno[2,3-c]isoquinoline-2-carboxamide Openeye Name: 1-amino-N-(4-bromophenyl)-5-phenethyl-6,7,8,9-tetrahydrothieno[2,3-c]isoquinoline-2-carboxamide CAS Name: 1-amino-N-(4-bromophenyl)-5-phenethyl-6,7,8,9-tetrahydrothieno[2,3-c]isoquinoline-2-carboxamide IUPAC Name: 1-amino-N-(4-bromophenyl)-5-phenethyl-6,7,8,9-tetrahydrothieno[2,3-c]isoquinoline-2-carboxamide Traditional Name: 1-amino-N-(4-bromophenyl)-5-phenethyl-6,7,8,9-tetrahydrothien[2,3-c]isoquinoline-2-carboxamide Formula: C26H24BrN3OS MolecularWeight: 506.45726

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C3C(=C(SC3=NC(=C2C1)CCC4=CC=CC=C4)C(=O)NC5=CC=C(C=C5)Br)N

Isomeric SMILES

C1CCC2=C3C(=C(SC3=NC(=C2C1)CCC4=CC=CC=C4)C(=O)NC5=CC=C(C=C5)Br)N

InChI

InChI=1S/C26H24BrN3OS/c27-17-11-13-18(14-12-17)29-25(31)24-23(28)22-20-9-5-4-8-19(20)21(30-26(22)32-24)15-10-16-6-2-1-3-7-16/h1-3,6-7,11-14H,4-5,8-10,15,28H2,(H,29,31)