3,6-bis(azanyl)-4-phenyl-2-(4-phenylphenyl)carbonyl-thieno[2,3-b]pyridine-5-carbonitrile

Systemtic Name: 3,6-bis(azanyl)-4-phenyl-2-(4-phenylphenyl)carbonyl-thieno[2,3-b]pyridine-5-carbonitrile Openeye Name: 3,6-diamino-4-phenyl-2-(4-phenylbenzoyl)thieno[2,3-b]pyridine-5-carbonitrile CAS Name: 3,6-diamino-2-[oxo-(4-phenylphenyl)methyl]-4-phenyl-5-thieno[2,3-b]pyridinecarbonitrile IUPAC Name: 3,6-diamino-4-phenyl-2-(4-phenylbenzoyl)thieno[2,3-b]pyridine-5-carbonitrile Traditional Name: 3,6-diamino-4-phenyl-2-(4-phenylbenzoyl)thieno[2,3-b]pyridine-5-carbonitrile Formula: C27H18N4OS MolecularWeight: 446.52302

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)C3=C(C4=C(S3)N=C(C(=C4C5=CC=CC=C5)C#N)N)N

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)C3=C(C4=C(S3)N=C(C(=C4C5=CC=CC=C5)C#N)N)N

InChI

InChI=1S/C27H18N4OS/c28-15-20-21(18-9-5-2-6-10-18)22-23(29)25(33-27(22)31-26(20)30)24(32)19-13-11-17(12-14-19)16-7-3-1-4-8-16/h1-14H,29H2,(H2,30,31)