1-[(5-bromanylthiophen-2-yl)-(3-chlorophenyl)methyl]-1,4-diazepane

Systemtic Name: 1-[(5-bromanylthiophen-2-yl)-(3-chlorophenyl)methyl]-1,4-diazepane Openeye Name: 1-[(5-bromo-2-thienyl)-(3-chlorophenyl)methyl]-1,4-diazepane CAS Name: 1-[(5-bromo-2-thiophenyl)-(3-chlorophenyl)methyl]-1,4-diazepane IUPAC Name: 1-[(5-bromothiophen-2-yl)-(3-chlorophenyl)methyl]-1,4-diazepane Traditional Name: 1-[(5-bromo-2-thienyl)-(3-chlorophenyl)methyl]-1,4-diazepane Formula: C16H18BrClN2S MolecularWeight: 385.74952

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H18BrClN2S/c17-15-6-5-14(21-15)16(12-3-1-4-13(18)11-12)20-9-2-7-19-8-10-20/h1,3-6,11,16,19H,2,7-10H2