3-azanyl-N-(4-bromophenyl)-4,6-bis(4-methoxyphenyl)thieno[2,3-b]pyridine-2-carboxamide

Systemtic Name: 3-azanyl-N-(4-bromophenyl)-4,6-bis(4-methoxyphenyl)thieno[2,3-b]pyridine-2-carboxamide Openeye Name: 3-amino-N-(4-bromophenyl)-4,6-bis(4-methoxyphenyl)thieno[2,3-b]pyridine-2-carboxamide CAS Name: 3-amino-N-(4-bromophenyl)-4,6-bis(4-methoxyphenyl)-2-thieno[2,3-b]pyridinecarboxamide IUPAC Name: 3-amino-N-(4-bromophenyl)-4,6-bis(4-methoxyphenyl)thieno[2,3-b]pyridine-2-carboxamide Traditional Name: 3-amino-N-(4-bromophenyl)-4,6-bis(4-methoxyphenyl)thieno[2,3-b]pyridine-2-carboxamide Formula: C28H22BrN3O3S MolecularWeight: 560.46158

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CC(=NC3=C2C(=C(S3)C(=O)NC4=CC=C(C=C4)Br)N)C5=CC=C(C=C5)OC

Isomeric SMILES

COC1=CC=C(C=C1)C2=CC(=NC3=C2C(=C(S3)C(=O)NC4=CC=C(C=C4)Br)N)C5=CC=C(C=C5)OC

InChI

InChI=1S/C28H22BrN3O3S/c1-34-20-11-3-16(4-12-20)22-15-23(17-5-13-21(35-2)14-6-17)32-28-24(22)25(30)26(36-28)27(33)31-19-9-7-18(29)8-10-19/h3-15H,30H2,1-2H3,(H,31,33)