4-[1-(4-methoxyphenyl)sulfanyl-3-phenyl-propan-2-yl]-1-methyl-1,4-diazepan-5-one

Systemtic Name: 4-[1-(4-methoxyphenyl)sulfanyl-3-phenyl-propan-2-yl]-1-methyl-1,4-diazepan-5-one Openeye Name: 4-[1-benzyl-2-(4-methoxyphenyl)sulfanyl-ethyl]-1-methyl-1,4-diazepan-5-one CAS Name: 4-[1-[(4-methoxyphenyl)thio]-3-phenylpropan-2-yl]-1-methyl-1,4-diazepan-5-one IUPAC Name: 4-[1-(4-methoxyphenyl)sulfanyl-3-phenylpropan-2-yl]-1-methyl-1,4-diazepan-5-one Traditional Name: 4-[1-benzyl-2-[(4-methoxyphenyl)thio]ethyl]-1-methyl-1,4-diazepan-5-one Formula: C22H28N2O2S MolecularWeight: 384.53492

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(=O)N(CC1)C(CC2=CC=CC=C2)CSC3=CC=C(C=C3)OC

Isomeric SMILES

CN1CCC(=O)N(CC1)C(CC2=CC=CC=C2)CSC3=CC=C(C=C3)OC

InChI

InChI=1S/C22H28N2O2S/c1-23-13-12-22(25)24(15-14-23)19(16-18-6-4-3-5-7-18)17-27-21-10-8-20(26-2)9-11-21/h3-11,19H,12-17H2,1-2H3