2-[4-(1H-thieno[3,4-d]imidazol-2-ylmethyl)piperazin-1-yl]pyridine-3-carbonitrile

Systemtic Name: 2-[4-(1H-thieno[3,4-d]imidazol-2-ylmethyl)piperazin-1-yl]pyridine-3-carbonitrile Openeye Name: 2-[4-(1H-thieno[3,4-d]imidazol-2-ylmethyl)piperazin-1-yl]pyridine-3-carbonitrile CAS Name: 2-[4-(1H-thieno[3,4-d]imidazol-2-ylmethyl)-1-piperazinyl]-3-pyridinecarbonitrile IUPAC Name: 2-[4-(1H-thieno[3,4-d]imidazol-2-ylmethyl)piperazin-1-yl]pyridine-3-carbonitrile Traditional Name: 2-[4-(1H-thien[3,4-d]imidazol-2-ylmethyl)piperazino]nicotinonitrile Formula: C16H16N6S MolecularWeight: 324.40344

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=NC3=CSC=C3N2)C4=C(C=CC=N4)C#N

Isomeric SMILES

C1CN(CCN1CC2=NC3=CSC=C3N2)C4=C(C=CC=N4)C#N

InChI

InChI=1S/C16H16N6S/c17-8-12-2-1-3-18-16(12)22-6-4-21(5-7-22)9-15-19-13-10-23-11-14(13)20-15/h1-3,10-11H,4-7,9H2,(H,19,20)