N-[4-[2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl]phenyl]-5-phenyl-1,2-oxazole-3-carboxamide

Systemtic Name: N-[4-[2-oxidanylidene-2-(thiophen-2-ylmethylamino)ethyl]phenyl]-5-phenyl-1,2-oxazole-3-carboxamide Openeye Name: N-[4-[2-oxo-2-(2-thienylmethylamino)ethyl]phenyl]-5-phenyl-isoxazole-3-carboxamide CAS Name: N-[4-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]phenyl]-5-phenyl-3-isoxazolecarboxamide IUPAC Name: N-[4-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]phenyl]-5-phenyl-1,2-oxazole-3-carboxamide Traditional Name: N-[4-[2-keto-2-(2-thenylamino)ethyl]phenyl]-5-phenyl-isoxazole-3-carboxamide Formula: C23H19N3O3S MolecularWeight: 417.48026

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=NO2)C(=O)NC3=CC=C(C=C3)CC(=O)NCC4=CC=CS4

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=NO2)C(=O)NC3=CC=C(C=C3)CC(=O)NCC4=CC=CS4

InChI

InChI=1S/C23H19N3O3S/c27-22(24-15-19-7-4-12-30-19)13-16-8-10-18(11-9-16)25-23(28)20-14-21(29-26-20)17-5-2-1-3-6-17/h1-12,14H,13,15H2,(H,24,27)(H,25,28)