1-[1-benzothiophen-3-yl-(2-ethoxyphenyl)methyl]-1,4-diazepane

Systemtic Name: 1-[1-benzothiophen-3-yl-(2-ethoxyphenyl)methyl]-1,4-diazepane Openeye Name: 1-[benzothiophen-3-yl-(2-ethoxyphenyl)methyl]-1,4-diazepane CAS Name: 1-[1-benzothiophen-3-yl-(2-ethoxyphenyl)methyl]-1,4-diazepane IUPAC Name: 1-[1-benzothiophen-3-yl-(2-ethoxyphenyl)methyl]-1,4-diazepane Traditional Name: 1-[benzothiophen-3-yl(o-phenetyl)methyl]-1,4-diazepane Formula: C22H26N2OS MolecularWeight: 366.51964

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C(C2=CSC3=CC=CC=C32)N4CCCNCC4

Isomeric SMILES

CCOC1=CC=CC=C1C(C2=CSC3=CC=CC=C32)N4CCCNCC4

InChI

InChI=1S/C22H26N2OS/c1-2-25-20-10-5-3-9-18(20)22(24-14-7-12-23-13-15-24)19-16-26-21-11-6-4-8-17(19)21/h3-6,8-11,16,22-23H,2,7,12-15H2,1H3