N-[4-[(4-aminophenyl)methyl]phenyl]-2-(1-azanyl-3-methylsulfanyl-propyl)-1,3-oxazole-4-carboxamide

Systemtic Name: N-[4-[(4-aminophenyl)methyl]phenyl]-2-(1-azanyl-3-methylsulfanyl-propyl)-1,3-oxazole-4-carboxamide Openeye Name: 2-(1-amino-3-methylsulfanyl-propyl)-N-[4-[(4-aminophenyl)methyl]phenyl]oxazole-4-carboxamide CAS Name: 2-[1-amino-3-(methylthio)propyl]-N-[4-[(4-aminophenyl)methyl]phenyl]-4-oxazolecarboxamide IUPAC Name: 2-(1-amino-3-methylsulfanylpropyl)-N-[4-[(4-aminophenyl)methyl]phenyl]-1,3-oxazole-4-carboxamide Traditional Name: N-[4-(4-aminobenzyl)phenyl]-2-[1-amino-3-(methylthio)propyl]oxazole-4-carboxamide Formula: C21H24N4O2S MolecularWeight: 396.50586

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C1=NC(=CO1)C(=O)NC2=CC=C(C=C2)CC3=CC=C(C=C3)N)N

Isomeric SMILES

CSCCC(C1=NC(=CO1)C(=O)NC2=CC=C(C=C2)CC3=CC=C(C=C3)N)N

InChI

InChI=1S/C21H24N4O2S/c1-28-11-10-18(23)21-25-19(13-27-21)20(26)24-17-8-4-15(5-9-17)12-14-2-6-16(22)7-3-14/h2-9,13,18H,10-12,22-23H2,1H3,(H,24,26)