N4,N5-bis(3-morpholin-4-ylpropyl)-3-(phenylsulfanylmethyl)-1,2-oxazole-4,5-dicarboxamide

Systemtic Name: N4,N5-bis(3-morpholin-4-ylpropyl)-3-(phenylsulfanylmethyl)-1,2-oxazole-4,5-dicarboxamide Openeye Name: N4,N5-bis(3-morpholinopropyl)-3-(phenylsulfanylmethyl)isoxazole-4,5-dicarboxamide CAS Name: N4,N5-bis[3-(4-morpholinyl)propyl]-3-[(phenylthio)methyl]isoxazole-4,5-dicarboxamide IUPAC Name: 4-N,5-N-bis(3-morpholin-4-ylpropyl)-3-(phenylsulfanylmethyl)-1,2-oxazole-4,5-dicarboxamide Traditional Name: N,N'-bis(3-morpholinopropyl)-3-[(phenylthio)methyl]isoxazole-4,5-dicarboxamide Formula: C26H37N5O5S MolecularWeight: 531.66748

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCCNC(=O)C2=C(ON=C2CSC3=CC=CC=C3)C(=O)NCCCN4CCOCC4

Isomeric SMILES

C1COCCN1CCCNC(=O)C2=C(ON=C2CSC3=CC=CC=C3)C(=O)NCCCN4CCOCC4

InChI

InChI=1S/C26H37N5O5S/c32-25(27-8-4-10-30-12-16-34-17-13-30)23-22(20-37-21-6-2-1-3-7-21)29-36-24(23)26(33)28-9-5-11-31-14-18-35-19-15-31/h1-3,6-7H,4-5,8-20H2,(H,27,32)(H,28,33)