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

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

C1=CC=C(C=C1)C(C2=CC=C(C=C2)C3C(ON=C3C4=CN=CC=C4)C(=O)N)C(=S)N

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=C(C=C2)C3C(ON=C3C4=CN=CC=C4)C(=O)N)C(=S)N

InChI

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