4-(5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yloxy)benzenecarbonitrile

Systemtic Name: 4-(5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yloxy)benzenecarbonitrile Openeye Name: 4-(5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-4-yloxy)benzonitrile CAS Name: 4-(5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yloxy)benzonitrile IUPAC Name: 4-(5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yloxy)benzonitrile Traditional Name: 4-(5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-4-yloxy)benzonitrile Formula: C17H13N3OS MolecularWeight: 307.36962

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C3=C(N=CN=C3S2)OC4=CC=C(C=C4)C#N

Isomeric SMILES

C1CCC2=C(C1)C3=C(N=CN=C3S2)OC4=CC=C(C=C4)C#N

InChI

InChI=1S/C17H13N3OS/c18-9-11-5-7-12(8-6-11)21-16-15-13-3-1-2-4-14(13)22-17(15)20-10-19-16/h5-8,10H,1-4H2