7-methoxy-7-phenyl-2,4,5,6-tetrahydro-1H-[1]benzothiolo[3,2-d]azonine-3-carbonitrile

Systemtic Name: 7-methoxy-7-phenyl-2,4,5,6-tetrahydro-1H-[1]benzothiolo[3,2-d]azonine-3-carbonitrile Openeye Name: 7-methoxy-7-phenyl-2,4,5,6-tetrahydro-1H-benzothiopheno[3,2-d]azonine-3-carbonitrile CAS Name: 7-methoxy-7-phenyl-2,4,5,6-tetrahydro-1H-[1]benzothiolo[3,2-d]azonine-3-carbonitrile IUPAC Name: 7-methoxy-7-phenyl-2,4,5,6-tetrahydro-1H-[1]benzothiolo[3,2-d]azonine-3-carbonitrile Traditional Name: 7-methoxy-7-phenyl-2,4,5,6-tetrahydro-1H-benzothiophen[3,2-d]azonine-3-carbonitrile Formula: C22H22N2OS MolecularWeight: 362.48788

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Descriptors Computed from Structure

Canonical SMILES:

COC1(CCCN(CCC2=C1SC3=CC=CC=C23)C#N)C4=CC=CC=C4

Isomeric SMILES

COC1(CCCN(CCC2=C1SC3=CC=CC=C23)C#N)C4=CC=CC=C4

InChI

InChI=1S/C22H22N2OS/c1-25-22(17-8-3-2-4-9-17)13-7-14-24(16-23)15-12-19-18-10-5-6-11-20(18)26-21(19)22/h2-6,8-11H,7,12-15H2,1H3