4-[(4-thieno[2,3-d]pyrimidin-4-ylpiperazin-1-yl)methyl]benzenecarbonitrile

Systemtic Name: 4-[(4-thieno[2,3-d]pyrimidin-4-ylpiperazin-1-yl)methyl]benzenecarbonitrile Openeye Name: 4-[(4-thieno[2,3-d]pyrimidin-4-ylpiperazin-1-yl)methyl]benzonitrile CAS Name: 4-[[4-(4-thieno[2,3-d]pyrimidinyl)-1-piperazinyl]methyl]benzonitrile IUPAC Name: 4-[(4-thieno[2,3-d]pyrimidin-4-ylpiperazin-1-yl)methyl]benzonitrile Traditional Name: 4-[(4-thieno[2,3-d]pyrimidin-4-ylpiperazino)methyl]benzonitrile Formula: C18H17N5S MolecularWeight: 335.42608

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(C=C2)C#N)C3=C4C=CSC4=NC=N3

Isomeric SMILES

C1CN(CCN1CC2=CC=C(C=C2)C#N)C3=C4C=CSC4=NC=N3

InChI

InChI=1S/C18H17N5S/c19-11-14-1-3-15(4-2-14)12-22-6-8-23(9-7-22)17-16-5-10-24-18(16)21-13-20-17/h1-5,10,13H,6-9,12H2