2-[4-[5-azanyl-6-oxidanylidene-6-(1,3-thiazolidin-3-yl)hexyl]piperazin-1-yl]pyridine-4-carbonitrile

Systemtic Name: 2-[4-[5-azanyl-6-oxidanylidene-6-(1,3-thiazolidin-3-yl)hexyl]piperazin-1-yl]pyridine-4-carbonitrile Openeye Name: 2-[4-(5-amino-6-oxo-6-thiazolidin-3-yl-hexyl)piperazin-1-yl]pyridine-4-carbonitrile CAS Name: 2-[4-[5-amino-6-oxo-6-(3-thiazolidinyl)hexyl]-1-piperazinyl]-4-pyridinecarbonitrile IUPAC Name: 2-[4-[5-amino-6-oxo-6-(1,3-thiazolidin-3-yl)hexyl]piperazin-1-yl]pyridine-4-carbonitrile Traditional Name: 2-[4-(5-amino-6-keto-6-thiazolidin-3-yl-hexyl)piperazino]isonicotinonitrile Formula: C19H28N6OS MolecularWeight: 388.53022

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCCC(C(=O)N2CCSC2)N)C3=NC=CC(=C3)C#N

Isomeric SMILES

C1CN(CCN1CCCCC(C(=O)N2CCSC2)N)C3=NC=CC(=C3)C#N

InChI

InChI=1S/C19H28N6OS/c20-14-16-4-5-22-18(13-16)24-9-7-23(8-10-24)6-2-1-3-17(21)19(26)25-11-12-27-15-25/h4-5,13,17H,1-3,6-12,15,21H2