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

Systemtic Name: 2-(1-azanyl-3-methylsulfanyl-propyl)-N-[(4-chlorophenyl)-phenyl-methyl]-1,3-oxazole-4-carboxamide Openeye Name: 2-(1-amino-3-methylsulfanyl-propyl)-N-[(4-chlorophenyl)-phenyl-methyl]oxazole-4-carboxamide CAS Name: 2-[1-amino-3-(methylthio)propyl]-N-[(4-chlorophenyl)-phenylmethyl]-4-oxazolecarboxamide IUPAC Name: 2-(1-amino-3-methylsulfanylpropyl)-N-[(4-chlorophenyl)-phenylmethyl]-1,3-oxazole-4-carboxamide Traditional Name: 2-[1-amino-3-(methylthio)propyl]-N-[(4-chlorophenyl)-phenyl-methyl]oxazole-4-carboxamide Formula: C21H22ClN3O2S MolecularWeight: 415.93628

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22ClN3O2S/c1-28-12-11-17(23)21-24-18(13-27-21)20(26)25-19(14-5-3-2-4-6-14)15-7-9-16(22)10-8-15/h2-10,13,17,19H,11-12,23H2,1H3,(H,25,26)