2-phenyl-2-propan-2-yl-5-[4-(2-quinazolin-4-yloxyethyl)piperazin-1-yl]pentanenitrile

Systemtic Name: 2-phenyl-2-propan-2-yl-5-[4-(2-quinazolin-4-yloxyethyl)piperazin-1-yl]pentanenitrile Openeye Name: 2-isopropyl-2-phenyl-5-[4-(2-quinazolin-4-yloxyethyl)piperazin-1-yl]pentanenitrile CAS Name: 2-phenyl-2-propan-2-yl-5-[4-[2-(4-quinazolinyloxy)ethyl]-1-piperazinyl]pentanenitrile IUPAC Name: 2-phenyl-2-propan-2-yl-5-[4-(2-quinazolin-4-yloxyethyl)piperazin-1-yl]pentanenitrile Traditional Name: 2-isopropyl-2-phenyl-5-[4-(2-quinazolin-4-yloxyethyl)piperazino]valeronitrile Formula: C28H35N5O MolecularWeight: 457.6104

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CCCN1CCN(CC1)CCOC2=NC=NC3=CC=CC=C32)(C#N)C4=CC=CC=C4

Isomeric SMILES

CC(C)C(CCCN1CCN(CC1)CCOC2=NC=NC3=CC=CC=C32)(C#N)C4=CC=CC=C4

InChI

InChI=1S/C28H35N5O/c1-23(2)28(21-29,24-9-4-3-5-10-24)13-8-14-32-15-17-33(18-16-32)19-20-34-27-25-11-6-7-12-26(25)30-22-31-27/h3-7,9-12,22-23H,8,13-20H2,1-2H3