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

Systemtic Name: 1-[1-benzothiophen-2-yl(pyridin-3-yl)methyl]-1,4-diazepane Openeye Name: 1-[benzothiophen-2-yl(3-pyridyl)methyl]-1,4-diazepane CAS Name: 1-[1-benzothiophen-2-yl(3-pyridinyl)methyl]-1,4-diazepane IUPAC Name: 1-[1-benzothiophen-2-yl(pyridin-3-yl)methyl]-1,4-diazepane Traditional Name: 1-[benzothiophen-2-yl(3-pyridyl)methyl]-1,4-diazepane Formula: C19H21N3S MolecularWeight: 323.45514

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCN(C1)C(C2=CN=CC=C2)C3=CC4=CC=CC=C4S3

Isomeric SMILES

C1CNCCN(C1)C(C2=CN=CC=C2)C3=CC4=CC=CC=C4S3

InChI

InChI=1S/C19H21N3S/c1-2-7-17-15(5-1)13-18(23-17)19(16-6-3-8-21-14-16)22-11-4-9-20-10-12-22/h1-3,5-8,13-14,19-20H,4,9-12H2