1-benzothiophen-2-yl-[4-[(3-methoxyphenyl)methyl]-1,4-diazepan-1-yl]methanone

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CN2CCCN(CC2)C(=O)C3=CC4=CC=CC=C4S3

Isomeric SMILES

COC1=CC=CC(=C1)CN2CCCN(CC2)C(=O)C3=CC4=CC=CC=C4S3

InChI

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