N-[[4-[[(3-methyl-1-benzofuran-2-yl)carbonylamino]carbamoyl]phenyl]methyl]adamantane-1-carboxamide

Systemtic Name: N-[[4-[[(3-methyl-1-benzofuran-2-yl)carbonylamino]carbamoyl]phenyl]methyl]adamantane-1-carboxamide Openeye Name: N-[[4-[[(3-methylbenzofuran-2-carbonyl)amino]carbamoyl]phenyl]methyl]adamantane-1-carboxamide CAS Name: N-[[4-[[[(3-methyl-2-benzofuranyl)-oxomethyl]hydrazo]-oxomethyl]phenyl]methyl]-1-adamantanecarboxamide IUPAC Name: N-[[4-[[(3-methyl-1-benzofuran-2-carbonyl)amino]carbamoyl]phenyl]methyl]adamantane-1-carboxamide Traditional Name: N-[4-[[(3-methylbenzofuran-2-carbonyl)amino]carbamoyl]benzyl]adamantane-1-carboxamide Formula: C29H31N3O4 MolecularWeight: 485.57414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=CC=CC=C12)C(=O)NNC(=O)C3=CC=C(C=C3)CNC(=O)C45CC6CC(C4)CC(C6)C5

Isomeric SMILES

CC1=C(OC2=CC=CC=C12)C(=O)NNC(=O)C3=CC=C(C=C3)CNC(=O)C45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C29H31N3O4/c1-17-23-4-2-3-5-24(23)36-25(17)27(34)32-31-26(33)22-8-6-18(7-9-22)16-30-28(35)29-13-19-10-20(14-29)12-21(11-19)15-29/h2-9,19-21H,10-16H2,1H3,(H,30,35)(H,31,33)(H,32,34)