2-[4-[4-[4-(2-azanyl-1,3-thiazol-4-yl)phenyl]butyl]piperazin-1-yl]pyridine-3-carbonitrile

Systemtic Name: 2-[4-[4-[4-(2-azanyl-1,3-thiazol-4-yl)phenyl]butyl]piperazin-1-yl]pyridine-3-carbonitrile Openeye Name: 2-[4-[4-[4-(2-aminothiazol-4-yl)phenyl]butyl]piperazin-1-yl]pyridine-3-carbonitrile CAS Name: 2-[4-[4-[4-(2-amino-4-thiazolyl)phenyl]butyl]-1-piperazinyl]-3-pyridinecarbonitrile IUPAC Name: 2-[4-[4-[4-(2-amino-1,3-thiazol-4-yl)phenyl]butyl]piperazin-1-yl]pyridine-3-carbonitrile Traditional Name: 2-[4-[4-[4-(2-aminothiazol-4-yl)phenyl]butyl]piperazino]nicotinonitrile Formula: C23H26N6S MolecularWeight: 418.55774

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCCC2=CC=C(C=C2)C3=CSC(=N3)N)C4=C(C=CC=N4)C#N

Isomeric SMILES

C1CN(CCN1CCCCC2=CC=C(C=C2)C3=CSC(=N3)N)C4=C(C=CC=N4)C#N

InChI

InChI=1S/C23H26N6S/c24-16-20-5-3-10-26-22(20)29-14-12-28(13-15-29)11-2-1-4-18-6-8-19(9-7-18)21-17-30-23(25)27-21/h3,5-10,17H,1-2,4,11-15H2,(H2,25,27)