N-[2-[(3-methylphenyl)carbamoyl-(4-phenoxyphenyl)amino]ethyl]pentanamide

Systemtic Name: N-[2-[(3-methylphenyl)carbamoyl-(4-phenoxyphenyl)amino]ethyl]pentanamide Openeye Name: N-[2-[N-(m-tolylcarbamoyl)-4-phenoxy-anilino]ethyl]pentanamide CAS Name: N-[2-(N-[(3-methylanilino)-oxomethyl]-4-phenoxyanilino)ethyl]pentanamide IUPAC Name: N-[2-[N-[(3-methylphenyl)carbamoyl]-4-phenoxyanilino]ethyl]pentanamide Traditional Name: N-[2-[N-(m-tolylcarbamoyl)-4-phenoxy-anilino]ethyl]valeramide Formula: C27H31N3O3 MolecularWeight: 445.55334

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NCCN(C1=CC=C(C=C1)OC2=CC=CC=C2)C(=O)NC3=CC=CC(=C3)C

Isomeric SMILES

CCCCC(=O)NCCN(C1=CC=C(C=C1)OC2=CC=CC=C2)C(=O)NC3=CC=CC(=C3)C

InChI

InChI=1S/C27H31N3O3/c1-3-4-13-26(31)28-18-19-30(27(32)29-22-10-8-9-21(2)20-22)23-14-16-25(17-15-23)33-24-11-6-5-7-12-24/h5-12,14-17,20H,3-4,13,18-19H2,1-2H3,(H,28,31)(H,29,32)