4-[[(2R)-2-acetamido-3-(4-methylphenyl)propanoyl]amino]-N-(4-cyanophenyl)piperidine-1-carboxamide

Systemtic Name: 4-[[(2R)-2-acetamido-3-(4-methylphenyl)propanoyl]amino]-N-(4-cyanophenyl)piperidine-1-carboxamide Openeye Name: 4-[[(2R)-2-acetamido-3-(p-tolyl)propanoyl]amino]-N-(4-cyanophenyl)piperidine-1-carboxamide CAS Name: 4-[[(2R)-2-acetamido-3-(4-methylphenyl)-1-oxopropyl]amino]-N-(4-cyanophenyl)-1-piperidinecarboxamide IUPAC Name: 4-[[(2R)-2-acetamido-3-(4-methylphenyl)propanoyl]amino]-N-(4-cyanophenyl)piperidine-1-carboxamide Traditional Name: 4-[[(2R)-2-acetamido-3-(p-tolyl)propanoyl]amino]-N-(4-cyanophenyl)piperidine-1-carboxamide Formula: C25H29N5O3 MolecularWeight: 447.52946

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CC(C(=O)NC2CCN(CC2)C(=O)NC3=CC=C(C=C3)C#N)NC(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)C[C@H](C(=O)NC2CCN(CC2)C(=O)NC3=CC=C(C=C3)C#N)NC(=O)C

InChI

InChI=1S/C25H29N5O3/c1-17-3-5-19(6-4-17)15-23(27-18(2)31)24(32)28-22-11-13-30(14-12-22)25(33)29-21-9-7-20(16-26)8-10-21/h3-10,22-23H,11-15H2,1-2H3,(H,27,31)(H,28,32)(H,29,33)/t23-/m1/s1