1-(1,3-benzothiazol-2-yl)-4-(3-methoxyphenyl)piperidine-4-carbonitrile

Systemtic Name: 1-(1,3-benzothiazol-2-yl)-4-(3-methoxyphenyl)piperidine-4-carbonitrile Openeye Name: 1-(1,3-benzothiazol-2-yl)-4-(3-methoxyphenyl)piperidine-4-carbonitrile CAS Name: 1-(1,3-benzothiazol-2-yl)-4-(3-methoxyphenyl)-4-piperidinecarbonitrile IUPAC Name: 1-(1,3-benzothiazol-2-yl)-4-(3-methoxyphenyl)piperidine-4-carbonitrile Traditional Name: 1-(1,3-benzothiazol-2-yl)-4-(3-methoxyphenyl)isonipecotonitrile Formula: C20H19N3OS MolecularWeight: 349.44936

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2(CCN(CC2)C3=NC4=CC=CC=C4S3)C#N

Isomeric SMILES

COC1=CC=CC(=C1)C2(CCN(CC2)C3=NC4=CC=CC=C4S3)C#N

InChI

InChI=1S/C20H19N3OS/c1-24-16-6-4-5-15(13-16)20(14-21)9-11-23(12-10-20)19-22-17-7-2-3-8-18(17)25-19/h2-8,13H,9-12H2,1H3