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

Systemtic Name: N-[4-(4-aminophenyl)carbonylphenyl]-2-(1-azanyl-3-methylsulfanyl-propyl)-1,3-oxazole-4-carboxamide Openeye Name: N-[4-(4-aminobenzoyl)phenyl]-2-(1-amino-3-methylsulfanyl-propyl)oxazole-4-carboxamide CAS Name: 2-[1-amino-3-(methylthio)propyl]-N-[4-[(4-aminophenyl)-oxomethyl]phenyl]-4-oxazolecarboxamide IUPAC Name: N-[4-(4-aminobenzoyl)phenyl]-2-(1-amino-3-methylsulfanylpropyl)-1,3-oxazole-4-carboxamide Traditional Name: N-[4-(4-aminobenzoyl)phenyl]-2-[1-amino-3-(methylthio)propyl]oxazole-4-carboxamide Formula: C21H22N4O3S MolecularWeight: 410.48938

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22N4O3S/c1-29-11-10-17(23)21-25-18(12-28-21)20(27)24-16-8-4-14(5-9-16)19(26)13-2-6-15(22)7-3-13/h2-9,12,17H,10-11,22-23H2,1H3,(H,24,27)