N4,N5-bis(phenylmethyl)-3-(pyridin-4-ylsulfanylmethyl)-1,2-oxazole-4,5-dicarboxamide

Systemtic Name: N4,N5-bis(phenylmethyl)-3-(pyridin-4-ylsulfanylmethyl)-1,2-oxazole-4,5-dicarboxamide Openeye Name: N4,N5-dibenzyl-3-(4-pyridylsulfanylmethyl)isoxazole-4,5-dicarboxamide CAS Name: N4,N5-bis(phenylmethyl)-3-[(pyridin-4-ylthio)methyl]isoxazole-4,5-dicarboxamide IUPAC Name: 4-N,5-N-dibenzyl-3-(pyridin-4-ylsulfanylmethyl)-1,2-oxazole-4,5-dicarboxamide Traditional Name: N,N'-dibenzyl-3-[(4-pyridylthio)methyl]isoxazole-4,5-dicarboxamide Formula: C25H22N4O3S MolecularWeight: 458.53218

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)C2=C(ON=C2CSC3=CC=NC=C3)C(=O)NCC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)C2=C(ON=C2CSC3=CC=NC=C3)C(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C25H22N4O3S/c30-24(27-15-18-7-3-1-4-8-18)22-21(17-33-20-11-13-26-14-12-20)29-32-23(22)25(31)28-16-19-9-5-2-6-10-19/h1-14H,15-17H2,(H,27,30)(H,28,31)