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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)C(C2=CSC3=CC=CC=C32)N4CCCNCC4

Isomeric SMILES

CCOC1=CC=CC(=C1)C(C2=CSC3=CC=CC=C32)N4CCCNCC4

InChI

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