N-[4-(4-cyclopropylcarbonyl-1,4-diazepan-1-yl)phenyl]-5-phenyl-1,2-oxazole-3-carboxamide

Systemtic Name: N-[4-(4-cyclopropylcarbonyl-1,4-diazepan-1-yl)phenyl]-5-phenyl-1,2-oxazole-3-carboxamide Openeye Name: N-[4-[4-(cyclopropanecarbonyl)-1,4-diazepan-1-yl]phenyl]-5-phenyl-isoxazole-3-carboxamide CAS Name: N-[4-[4-[cyclopropyl(oxo)methyl]-1,4-diazepan-1-yl]phenyl]-5-phenyl-3-isoxazolecarboxamide IUPAC Name: N-[4-[4-(cyclopropanecarbonyl)-1,4-diazepan-1-yl]phenyl]-5-phenyl-1,2-oxazole-3-carboxamide Traditional Name: N-[4-[4-(cyclopropanecarbonyl)-1,4-diazepan-1-yl]phenyl]-5-phenyl-isoxazole-3-carboxamide Formula: C25H26N4O3 MolecularWeight: 430.49894

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=O)C2CC2)C3=CC=C(C=C3)NC(=O)C4=NOC(=C4)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN(C1)C(=O)C2CC2)C3=CC=C(C=C3)NC(=O)C4=NOC(=C4)C5=CC=CC=C5

InChI

InChI=1S/C25H26N4O3/c30-24(22-17-23(32-27-22)18-5-2-1-3-6-18)26-20-9-11-21(12-10-20)28-13-4-14-29(16-15-28)25(31)19-7-8-19/h1-3,5-6,9-12,17,19H,4,7-8,13-16H2,(H,26,30)