6-piperazin-1-yl-2-propan-2-yl-7-pyridin-2-yloxy-2-thiophen-2-yl-heptanenitrile

Systemtic Name: 6-piperazin-1-yl-2-propan-2-yl-7-pyridin-2-yloxy-2-thiophen-2-yl-heptanenitrile Openeye Name: 2-isopropyl-6-piperazin-1-yl-7-(2-pyridyloxy)-2-(2-thienyl)heptanenitrile CAS Name: 6-(1-piperazinyl)-2-propan-2-yl-7-(2-pyridinyloxy)-2-thiophen-2-ylheptanenitrile IUPAC Name: 6-piperazin-1-yl-2-propan-2-yl-7-pyridin-2-yloxy-2-thiophen-2-ylheptanenitrile Traditional Name: 2-isopropyl-6-piperazino-7-(2-pyridyloxy)-2-(2-thienyl)enanthonitrile Formula: C23H32N4OS MolecularWeight: 412.59138

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CCCC(COC1=CC=CC=N1)N2CCNCC2)(C#N)C3=CC=CS3

Isomeric SMILES

CC(C)C(CCCC(COC1=CC=CC=N1)N2CCNCC2)(C#N)C3=CC=CS3

InChI

InChI=1S/C23H32N4OS/c1-19(2)23(18-24,21-8-6-16-29-21)10-5-7-20(27-14-12-25-13-15-27)17-28-22-9-3-4-11-26-22/h3-4,6,8-9,11,16,19-20,25H,5,7,10,12-15,17H2,1-2H3