4-[[4-[(3-methyl-5-propan-2-yl-1,2-oxazol-4-yl)carbonyl]piperazin-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 4-[[4-[(3-methyl-5-propan-2-yl-1,2-oxazol-4-yl)carbonyl]piperazin-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[4-(5-isopropyl-3-methyl-isoxazole-4-carbonyl)piperazin-1-yl]methyl]benzonitrile CAS Name: 4-[[4-[(3-methyl-5-propan-2-yl-4-isoxazolyl)-oxomethyl]-1-piperazinyl]methyl]benzonitrile IUPAC Name: 4-[[4-(3-methyl-5-propan-2-yl-1,2-oxazole-4-carbonyl)piperazin-1-yl]methyl]benzonitrile Traditional Name: 4-[[4-(5-isopropyl-3-methyl-isoxazole-4-carbonyl)piperazino]methyl]benzonitrile Formula: C20H24N4O2 MolecularWeight: 352.43016

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1C(=O)N2CCN(CC2)CC3=CC=C(C=C3)C#N)C(C)C

Isomeric SMILES

CC1=NOC(=C1C(=O)N2CCN(CC2)CC3=CC=C(C=C3)C#N)C(C)C

InChI

InChI=1S/C20H24N4O2/c1-14(2)19-18(15(3)22-26-19)20(25)24-10-8-23(9-11-24)13-17-6-4-16(12-21)5-7-17/h4-7,14H,8-11,13H2,1-3H3