4-(azepan-1-yl)-5-(4-phenylphenyl)thieno[2,3-d]pyrimidine

Systemtic Name: 4-(azepan-1-yl)-5-(4-phenylphenyl)thieno[2,3-d]pyrimidine Openeye Name: 4-(azepan-1-yl)-5-(4-phenylphenyl)thieno[2,3-d]pyrimidine CAS Name: 4-(1-azepanyl)-5-(4-phenylphenyl)thieno[2,3-d]pyrimidine IUPAC Name: 4-(azepan-1-yl)-5-(4-phenylphenyl)thieno[2,3-d]pyrimidine Traditional Name: 4-(azepan-1-yl)-5-(4-phenylphenyl)thieno[2,3-d]pyrimidine Formula: C24H23N3S MolecularWeight: 385.52452

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=C3C(=CSC3=NC=N2)C4=CC=C(C=C4)C5=CC=CC=C5

Isomeric SMILES

C1CCCN(CC1)C2=C3C(=CSC3=NC=N2)C4=CC=C(C=C4)C5=CC=CC=C5

InChI

InChI=1S/C24H23N3S/c1-2-7-15-27(14-6-1)23-22-21(16-28-24(22)26-17-25-23)20-12-10-19(11-13-20)18-8-4-3-5-9-18/h3-5,8-13,16-17H,1-2,6-7,14-15H2