1-[(5-bromanylthiophen-2-yl)-phenyl-methyl]-1,4-diazepane

Systemtic Name: 1-[(5-bromanylthiophen-2-yl)-phenyl-methyl]-1,4-diazepane Openeye Name: 1-[(5-bromo-2-thienyl)-phenyl-methyl]-1,4-diazepane CAS Name: 1-[(5-bromo-2-thiophenyl)-phenylmethyl]-1,4-diazepane IUPAC Name: 1-[(5-bromothiophen-2-yl)-phenylmethyl]-1,4-diazepane Traditional Name: 1-[(5-bromo-2-thienyl)-phenyl-methyl]-1,4-diazepane Formula: C16H19BrN2S MolecularWeight: 351.30446

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCN(C1)C(C2=CC=CC=C2)C3=CC=C(S3)Br

Isomeric SMILES

C1CNCCN(C1)C(C2=CC=CC=C2)C3=CC=C(S3)Br

InChI

InChI=1S/C16H19BrN2S/c17-15-8-7-14(20-15)16(13-5-2-1-3-6-13)19-11-4-9-18-10-12-19/h1-3,5-8,16,18H,4,9-12H2