4-(azepan-1-yl)-2-(4-chloranyl-3-fluoranyl-phenyl)thieno[3,2-d]pyrimidine

Systemtic Name: 4-(azepan-1-yl)-2-(4-chloranyl-3-fluoranyl-phenyl)thieno[3,2-d]pyrimidine Openeye Name: 4-(azepan-1-yl)-2-(4-chloro-3-fluoro-phenyl)thieno[3,2-d]pyrimidine CAS Name: 4-(1-azepanyl)-2-(4-chloro-3-fluorophenyl)thieno[3,2-d]pyrimidine IUPAC Name: 4-(azepan-1-yl)-2-(4-chloro-3-fluorophenyl)thieno[3,2-d]pyrimidine Traditional Name: 4-(azepan-1-yl)-2-(4-chloro-3-fluoro-phenyl)thieno[3,2-d]pyrimidine Formula: C18H17ClFN3S MolecularWeight: 361.864083

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=NC(=NC3=C2SC=C3)C4=CC(=C(C=C4)Cl)F

Isomeric SMILES

C1CCCN(CC1)C2=NC(=NC3=C2SC=C3)C4=CC(=C(C=C4)Cl)F

InChI

InChI=1S/C18H17ClFN3S/c19-13-6-5-12(11-14(13)20)17-21-15-7-10-24-16(15)18(22-17)23-8-3-1-2-4-9-23/h5-7,10-11H,1-4,8-9H2