N-[4-(2-azanyl-1-phenyl-2-sulfanylidene-ethyl)phenyl]-3-pyridin-3-yl-4,5-dihydro-1,2-oxazole-5-carboxamide

Systemtic Name: N-[4-(2-azanyl-1-phenyl-2-sulfanylidene-ethyl)phenyl]-3-pyridin-3-yl-4,5-dihydro-1,2-oxazole-5-carboxamide Openeye Name: N-[4-(2-amino-1-phenyl-2-thioxo-ethyl)phenyl]-3-(3-pyridyl)-4,5-dihydroisoxazole-5-carboxamide CAS Name: N-[4-(2-amino-1-phenyl-2-sulfanylideneethyl)phenyl]-3-(3-pyridinyl)-4,5-dihydroisoxazole-5-carboxamide IUPAC Name: N-[4-(2-amino-1-phenyl-2-sulfanylideneethyl)phenyl]-3-pyridin-3-yl-4,5-dihydro-1,2-oxazole-5-carboxamide Traditional Name: N-[4-(2-amino-1-phenyl-2-thioxo-ethyl)phenyl]-3-(3-pyridyl)-2-isoxazoline-5-carboxamide Formula: C23H20N4O2S MolecularWeight: 416.4955

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Descriptors Computed from Structure

Canonical SMILES:

C1C(ON=C1C2=CN=CC=C2)C(=O)NC3=CC=C(C=C3)C(C4=CC=CC=C4)C(=S)N

Isomeric SMILES

C1C(ON=C1C2=CN=CC=C2)C(=O)NC3=CC=C(C=C3)C(C4=CC=CC=C4)C(=S)N

InChI

InChI=1S/C23H20N4O2S/c24-22(30)21(15-5-2-1-3-6-15)16-8-10-18(11-9-16)26-23(28)20-13-19(27-29-20)17-7-4-12-25-14-17/h1-12,14,20-21H,13H2,(H2,24,30)(H,26,28)