N-[4-[3-(2-acetamidoethylcarbamoyl)-5-phenylazanyl-phenyl]pyridin-2-yl]oxolane-3-carboxamide

Systemtic Name: N-[4-[3-(2-acetamidoethylcarbamoyl)-5-phenylazanyl-phenyl]pyridin-2-yl]oxolane-3-carboxamide Openeye Name: N-[4-[3-(2-acetamidoethylcarbamoyl)-5-anilino-phenyl]-2-pyridyl]tetrahydrofuran-3-carboxamide CAS Name: N-[4-[3-[(2-acetamidoethylamino)-oxomethyl]-5-anilinophenyl]-2-pyridinyl]-3-oxolanecarboxamide IUPAC Name: N-[4-[3-(2-acetamidoethylcarbamoyl)-5-anilinophenyl]pyridin-2-yl]oxolane-3-carboxamide Traditional Name: N-[4-[3-(2-acetamidoethylcarbamoyl)-5-anilino-phenyl]-2-pyridyl]tetrahydrofuran-3-carboxamide Formula: C27H29N5O4 MolecularWeight: 487.55026

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCCNC(=O)C1=CC(=CC(=C1)C2=CC(=NC=C2)NC(=O)C3CCOC3)NC4=CC=CC=C4

Isomeric SMILES

CC(=O)NCCNC(=O)C1=CC(=CC(=C1)C2=CC(=NC=C2)NC(=O)C3CCOC3)NC4=CC=CC=C4

InChI

InChI=1S/C27H29N5O4/c1-18(33)28-10-11-30-26(34)22-13-21(14-24(15-22)31-23-5-3-2-4-6-23)19-7-9-29-25(16-19)32-27(35)20-8-12-36-17-20/h2-7,9,13-16,20,31H,8,10-12,17H2,1H3,(H,28,33)(H,30,34)(H,29,32,35)