2-[4-[[2-(4-ethoxy-3-methoxy-phenyl)-1,3-thiazol-4-yl]methyl]piperazin-1-yl]pyridine-4-carbonitrile

Systemtic Name: 2-[4-[[2-(4-ethoxy-3-methoxy-phenyl)-1,3-thiazol-4-yl]methyl]piperazin-1-yl]pyridine-4-carbonitrile Openeye Name: 2-[4-[[2-(4-ethoxy-3-methoxy-phenyl)thiazol-4-yl]methyl]piperazin-1-yl]pyridine-4-carbonitrile CAS Name: 2-[4-[[2-(4-ethoxy-3-methoxyphenyl)-4-thiazolyl]methyl]-1-piperazinyl]-4-pyridinecarbonitrile IUPAC Name: 2-[4-[[2-(4-ethoxy-3-methoxyphenyl)-1,3-thiazol-4-yl]methyl]piperazin-1-yl]pyridine-4-carbonitrile Traditional Name: 2-[4-[[2-(4-ethoxy-3-methoxy-phenyl)thiazol-4-yl]methyl]piperazino]isonicotinonitrile Formula: C23H25N5O2S MolecularWeight: 435.5419

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C2=NC(=CS2)CN3CCN(CC3)C4=NC=CC(=C4)C#N)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C2=NC(=CS2)CN3CCN(CC3)C4=NC=CC(=C4)C#N)OC

InChI

InChI=1S/C23H25N5O2S/c1-3-30-20-5-4-18(13-21(20)29-2)23-26-19(16-31-23)15-27-8-10-28(11-9-27)22-12-17(14-24)6-7-25-22/h4-7,12-13,16H,3,8-11,15H2,1-2H3