1-phenethyl-4-(2-phenylsulfanylethyl)-1,4-diazepan-5-one

Systemtic Name: 1-phenethyl-4-(2-phenylsulfanylethyl)-1,4-diazepan-5-one Openeye Name: 1-phenethyl-4-(2-phenylsulfanylethyl)-1,4-diazepan-5-one CAS Name: 1-phenethyl-4-[2-(phenylthio)ethyl]-1,4-diazepan-5-one IUPAC Name: 1-phenethyl-4-(2-phenylsulfanylethyl)-1,4-diazepan-5-one Traditional Name: 1-phenethyl-4-[2-(phenylthio)ethyl]-1,4-diazepan-5-one Formula: C21H26N2OS MolecularWeight: 354.50894

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1=O)CCSC2=CC=CC=C2)CCC3=CC=CC=C3

Isomeric SMILES

C1CN(CCN(C1=O)CCSC2=CC=CC=C2)CCC3=CC=CC=C3

InChI

InChI=1S/C21H26N2OS/c24-21-12-14-22(13-11-19-7-3-1-4-8-19)15-16-23(21)17-18-25-20-9-5-2-6-10-20/h1-10H,11-18H2