N-[2,6-di(propan-2-yl)phenyl]-3-(2-oxidanylidene-4-phenyl-piperazin-1-yl)propanamide

Systemtic Name: N-[2,6-di(propan-2-yl)phenyl]-3-(2-oxidanylidene-4-phenyl-piperazin-1-yl)propanamide Openeye Name: N-(2,6-diisopropylphenyl)-3-(2-oxo-4-phenyl-piperazin-1-yl)propanamide CAS Name: N-[2,6-di(propan-2-yl)phenyl]-3-(2-oxo-4-phenyl-1-piperazinyl)propanamide IUPAC Name: N-[2,6-di(propan-2-yl)phenyl]-3-(2-oxo-4-phenylpiperazin-1-yl)propanamide Traditional Name: N-(2,6-diisopropylphenyl)-3-(2-keto-4-phenyl-piperazino)propionamide Formula: C25H33N3O2 MolecularWeight: 407.54842

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(C(=CC=C1)C(C)C)NC(=O)CCN2CCN(CC2=O)C3=CC=CC=C3

Isomeric SMILES

CC(C)C1=C(C(=CC=C1)C(C)C)NC(=O)CCN2CCN(CC2=O)C3=CC=CC=C3

InChI

InChI=1S/C25H33N3O2/c1-18(2)21-11-8-12-22(19(3)4)25(21)26-23(29)13-14-27-15-16-28(17-24(27)30)20-9-6-5-7-10-20/h5-12,18-19H,13-17H2,1-4H3,(H,26,29)