2-[[4-[4-(3-bromophenyl)-1,3-thiazol-2-yl]piperidin-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 2-[[4-[4-(3-bromophenyl)-1,3-thiazol-2-yl]piperidin-1-yl]methyl]benzenecarbonitrile Openeye Name: 2-[[4-[4-(3-bromophenyl)thiazol-2-yl]-1-piperidyl]methyl]benzonitrile CAS Name: 2-[[4-[4-(3-bromophenyl)-2-thiazolyl]-1-piperidinyl]methyl]benzonitrile IUPAC Name: 2-[[4-[4-(3-bromophenyl)-1,3-thiazol-2-yl]piperidin-1-yl]methyl]benzonitrile Traditional Name: 2-[[4-[4-(3-bromophenyl)thiazol-2-yl]piperidino]methyl]benzonitrile Formula: C22H20BrN3S MolecularWeight: 438.3833

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=NC(=CS2)C3=CC(=CC=C3)Br)CC4=CC=CC=C4C#N

Isomeric SMILES

C1CN(CCC1C2=NC(=CS2)C3=CC(=CC=C3)Br)CC4=CC=CC=C4C#N

InChI

InChI=1S/C22H20BrN3S/c23-20-7-3-6-17(12-20)21-15-27-22(25-21)16-8-10-26(11-9-16)14-19-5-2-1-4-18(19)13-24/h1-7,12,15-16H,8-11,14H2