1-(1-benzothiophen-2-ylmethyl)-4-[(3-methoxyphenyl)methyl]-1,4-diazepan-5-one

Systemtic Name: 1-(1-benzothiophen-2-ylmethyl)-4-[(3-methoxyphenyl)methyl]-1,4-diazepan-5-one Openeye Name: 1-(benzothiophen-2-ylmethyl)-4-[(3-methoxyphenyl)methyl]-1,4-diazepan-5-one CAS Name: 1-(1-benzothiophen-2-ylmethyl)-4-[(3-methoxyphenyl)methyl]-1,4-diazepan-5-one IUPAC Name: 1-(1-benzothiophen-2-ylmethyl)-4-[(3-methoxyphenyl)methyl]-1,4-diazepan-5-one Traditional Name: 1-(benzothiophen-2-ylmethyl)-4-m-anisyl-1,4-diazepan-5-one Formula: C22H24N2O2S MolecularWeight: 380.50316

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CN2CCN(CCC2=O)CC3=CC4=CC=CC=C4S3

Isomeric SMILES

COC1=CC=CC(=C1)CN2CCN(CCC2=O)CC3=CC4=CC=CC=C4S3

InChI

InChI=1S/C22H24N2O2S/c1-26-19-7-4-5-17(13-19)15-24-12-11-23(10-9-22(24)25)16-20-14-18-6-2-3-8-21(18)27-20/h2-8,13-14H,9-12,15-16H2,1H3