2-[2-[2-[(2R)-2-(phenylmethyl)piperazin-1-yl]carbonylthiophen-3-yl]phenoxy]pyridine-3-carbonitrile

Systemtic Name: 2-[2-[2-[(2R)-2-(phenylmethyl)piperazin-1-yl]carbonylthiophen-3-yl]phenoxy]pyridine-3-carbonitrile Openeye Name: 2-[2-[2-[(2R)-2-benzylpiperazine-1-carbonyl]-3-thienyl]phenoxy]pyridine-3-carbonitrile CAS Name: 2-[2-[2-[oxo-[(2R)-2-(phenylmethyl)-1-piperazinyl]methyl]-3-thiophenyl]phenoxy]-3-pyridinecarbonitrile IUPAC Name: 2-[2-[2-[(2R)-2-benzylpiperazine-1-carbonyl]thiophen-3-yl]phenoxy]pyridine-3-carbonitrile Traditional Name: 2-[2-[2-[(2R)-2-benzylpiperazine-1-carbonyl]-3-thienyl]phenoxy]nicotinonitrile Formula: C28H24N4O2S MolecularWeight: 480.58076

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(CN1)CC2=CC=CC=C2)C(=O)C3=C(C=CS3)C4=CC=CC=C4OC5=C(C=CC=N5)C#N

Isomeric SMILES

C1CN([C@@H](CN1)CC2=CC=CC=C2)C(=O)C3=C(C=CS3)C4=CC=CC=C4OC5=C(C=CC=N5)C#N

InChI

InChI=1S/C28H24N4O2S/c29-18-21-9-6-13-31-27(21)34-25-11-5-4-10-23(25)24-12-16-35-26(24)28(33)32-15-14-30-19-22(32)17-20-7-2-1-3-8-20/h1-13,16,22,30H,14-15,17,19H2/t22-/m1/s1