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

Systemtic Name: 1-[1-benzothiophen-2-yl-(2-methoxyphenyl)methyl]-1,4-diazepane Openeye Name: 1-[benzothiophen-2-yl-(2-methoxyphenyl)methyl]-1,4-diazepane CAS Name: 1-[1-benzothiophen-2-yl-(2-methoxyphenyl)methyl]-1,4-diazepane IUPAC Name: 1-[1-benzothiophen-2-yl-(2-methoxyphenyl)methyl]-1,4-diazepane Traditional Name: 1-[benzothiophen-2-yl-(2-methoxyphenyl)methyl]-1,4-diazepane Formula: C21H24N2OS MolecularWeight: 352.49306

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(C2=CC3=CC=CC=C3S2)N4CCCNCC4

Isomeric SMILES

COC1=CC=CC=C1C(C2=CC3=CC=CC=C3S2)N4CCCNCC4

InChI

InChI=1S/C21H24N2OS/c1-24-18-9-4-3-8-17(18)21(23-13-6-11-22-12-14-23)20-15-16-7-2-5-10-19(16)25-20/h2-5,7-10,15,21-22H,6,11-14H2,1H3